N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)

C180H277ClN50O56P10S8 — CID 165078420

IUPACN-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)
SMILESCC[C@@H]1CN([P@@](=O)(OCC2CN([P@@](=O)(OCC3CN([P@@](=O)(OCC4CN([P@@](=O)(OCC5CNC[C@H](n6cc(C)c(=O)[nH]c6=O)O5)N(C)C)C[C@H](n5cc(C)c(=O)[nH]c5=O)O4)N(C)C)C[C@H](n4cnc5c4C=C(NCC(C)C)CC5=O)O3)N(C)C)C[C@H](n3ccc(NC(=O)c4ccccc4)nc3=O)O2)N(C)C)C[C@H](n2ccc(NC(=O)c3ccccc3)nc2=O)O1.S.S.S.S.S.S.S.S.[2H][C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(Cl)N(C)C.[2H][C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(N(C)C)N1CC(CO[P@@](=O)(N(C)C)N2CC(CO[P@@](=O)(N(C)C)N3CC(CO[P@@](=O)(N(C)C)N4CC(CO[P@@](=O)(N(C)C)N5C[C@@H](CC)O[C@@H](n6ccc(NC(=O)c7ccccc7)nc6=O)C5)O[C@@H](n5ccc(NC(=O)c6ccccc6)nc5=O)C4)O[C@@H](n4cnc5c4C=C(NCC(C)C)CC5=O)C3)O[C@@H](n3cc(C)c(=O)[nH]c3=O)C2)O[C@@H](n2cc(C)c(=O)[nH]c2=O)C1.[3H]OC.[3H]OC
InChIInChI=1S/C89H126N25O27P5.C77H108N22O22P4.C12H19ClN3O5P.2CH4O.8H2S/c1-17-63-40-104(45-74(136-63)109-32-30-71(94-85(109)121)92-83(119)60-24-20-18-21-25-60)142(126,99(7)8)132-51-65-41-105(46-75(138-65)110-33-31-72(95-86(110)122)93-84(120)61-26-22-19-23-27-61)144(128,101(11)12)135-54-68-44-108(49-78(141-68)114-55-91-79-69(114)34-62(35-70(79)115)90-36-56(2)3)146(130,103(15)16)134-53-67-43-107(48-77(140-67)113-39-59(6)82(118)98-89(113)125)145(129,102(13)14)133-52-66-42-106(47-76(139-66)112-38-58(5)81(117)97-88(112)124)143(127,100(9)10)131-50-64-28-29-73(137-64)111-37-57(4)80(116)96-87(111)123;1-14-55-36-91(40-65(117-55)95-27-25-62(83-74(95)105)81-72(103)52-21-17-15-18-22-52)122(109,87(6)7)114-45-57-37-92(41-66(119-57)96-28-26-63(84-75(96)106)82-73(104)53-23-19-16-20-24-53)124(111,89(10)11)116-47-59-39-94(43-68(121-59)99-48-80-69-60(99)29-54(30-61(69)100)79-31-49(2)3)125(112,90(12)13)115-46-58-38-93(42-67(120-58)98-35-51(5)71(102)86-77(98)108)123(110,88(8)9)113-44-56-32-78-33-64(118-56)97-34-50(4)70(101)85-76(97)107;1-8-6-16(12(18)14-11(8)17)10-5-4-9(21-10)7-20-22(13,19)15(2)3;2*1-2;;;;;;;;/h18-27,30-34,37-39,55-56,63-68,73-78,90H,17,28-29,35-36,40-54H2,1-16H3,(H,96,116,123)(H,97,117,124)(H,98,118,125)(H,92,94,119,121)(H,93,95,120,122);15-29,34-35,48-49,55-59,64-68,78-79H,14,30-33,36-47H2,1-13H3,(H,85,101,107)(H,86,102,108)(H,81,83,103,105)(H,82,84,104,106);6,9-10H,4-5,7H2,1-3H3,(H,14,17,18);2*2H,1H3;8*1H2/t63-,64?,65?,66?,67?,68?,73-,74-,75-,76-,77-,78-,142+,143?,144+,145+,146+;55-,56?,57?,58?,59?,64-,65-,66-,67-,68-,122+,123+,124+,125+;9?,10-,22?;;;;;;;;;;/m111........../s1/i28D;;4D;2*2T;;;;;;;;/t28-,63+,64?,65?,66?,67?,68?,73+,74+,75+,76+,77+,78+,142-,143?,144-,145-,146-;m;4-,9?,10+,22?;;;;;;;;;;/m010..........
InChIKeyUSDYXLYOQHWBLY-NCFOOAOVSA-N
MW4645.25 g/mol
LogP10.96
Rot. Bonds77

About N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)

N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane) (PubChem CID 165078420) has the molecular formula C180H277ClN50O56P10S8 and a molecular weight of 4645.25 g/mol. Its IUPAC name is N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane).

Molecular Properties

Compound NameN-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)
PubChem CID165078420
Molecular FormulaC180H277ClN50O56P10S8
Molecular Weight4645.25 g/mol
Exact Mass4641.55
IUPAC NameN-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)
SMILESCC[C@@H]1CN([P@@](=O)(OCC2CN([P@@](=O)(OCC3CN([P@@](=O)(OCC4CN([P@@](=O)(OCC5CNC[C@H](n6cc(C)c(=O)[nH]c6=O)O5)N(C)C)C[C@H](n5cc(C)c(=O)[nH]c5=O)O4)N(C)C)C[C@H](n4cnc5c4C=C(NCC(C)C)CC5=O)O3)N(C)C)C[C@H](n3ccc(NC(=O)c4ccccc4)nc3=O)O2)N(C)C)C[C@H](n2ccc(NC(=O)c3ccccc3)nc2=O)O1.S.S.S.S.S.S.S.S.[2H][C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(Cl)N(C)C.[2H][C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(N(C)C)N1CC(CO[P@@](=O)(N(C)C)N2CC(CO[P@@](=O)(N(C)C)N3CC(CO[P@@](=O)(N(C)C)N4CC(CO[P@@](=O)(N(C)C)N5C[C@@H](CC)O[C@@H](n6ccc(NC(=O)c7ccccc7)nc6=O)C5)O[C@@H](n5ccc(NC(=O)c6ccccc6)nc5=O)C4)O[C@@H](n4cnc5c4C=C(NCC(C)C)CC5=O)C3)O[C@@H](n3cc(C)c(=O)[nH]c3=O)C2)O[C@@H](n2cc(C)c(=O)[nH]c2=O)C1.[3H]OC.[3H]OC
InChIInChI=1S/C89H126N25O27P5.C77H108N22O22P4.C12H19ClN3O5P.2CH4O.8H2S/c1-17-63-40-104(45-74(136-63)109-32-30-71(94-85(109)121)92-83(119)60-24-20-18-21-25-60)142(126,99(7)8)132-51-65-41-105(46-75(138-65)110-33-31-72(95-86(110)122)93-84(120)61-26-22-19-23-27-61)144(128,101(11)12)135-54-68-44-108(49-78(141-68)114-55-91-79-69(114)34-62(35-70(79)115)90-36-56(2)3)146(130,103(15)16)134-53-67-43-107(48-77(140-67)113-39-59(6)82(118)98-89(113)125)145(129,102(13)14)133-52-66-42-106(47-76(139-66)112-38-58(5)81(117)97-88(112)124)143(127,100(9)10)131-50-64-28-29-73(137-64)111-37-57(4)80(116)96-87(111)123;1-14-55-36-91(40-65(117-55)95-27-25-62(83-74(95)105)81-72(103)52-21-17-15-18-22-52)122(109,87(6)7)114-45-57-37-92(41-66(119-57)96-28-26-63(84-75(96)106)82-73(104)53-23-19-16-20-24-53)124(111,89(10)11)116-47-59-39-94(43-68(121-59)99-48-80-69-60(99)29-54(30-61(69)100)79-31-49(2)3)125(112,90(12)13)115-46-58-38-93(42-67(120-58)98-35-51(5)71(102)86-77(98)108)123(110,88(8)9)113-44-56-32-78-33-64(118-56)97-34-50(4)70(101)85-76(97)107;1-8-6-16(12(18)14-11(8)17)10-5-4-9(21-10)7-20-22(13,19)15(2)3;2*1-2;;;;;;;;/h18-27,30-34,37-39,55-56,63-68,73-78,90H,17,28-29,35-36,40-54H2,1-16H3,(H,96,116,123)(H,97,117,124)(H,98,118,125)(H,92,94,119,121)(H,93,95,120,122);15-29,34-35,48-49,55-59,64-68,78-79H,14,30-33,36-47H2,1-13H3,(H,85,101,107)(H,86,102,108)(H,81,83,103,105)(H,82,84,104,106);6,9-10H,4-5,7H2,1-3H3,(H,14,17,18);2*2H,1H3;8*1H2/t63-,64?,65?,66?,67?,68?,73-,74-,75-,76-,77-,78-,142+,143?,144+,145+,146+;55-,56?,57?,58?,59?,64-,65-,66-,67-,68-,122+,123+,124+,125+;9?,10-,22?;;;;;;;;;;/m111........../s1/i28D;;4D;2*2T;;;;;;;;/t28-,63+,64?,65?,66?,67?,68?,73+,74+,75+,76+,77+,78+,142-,143?,144-,145-,146-;m;4-,9?,10+,22?;;;;;;;;;;/m010..........
InChIKeyUSDYXLYOQHWBLY-NCFOOAOVSA-N
XLogP10.96
TPSA1166.77 Ų
H-Bond Donors15
H-Bond Acceptors77
Rotatable Bonds77
Heavy Atoms305
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004645.25
LogP ≤ 510.96
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1077

Analyze N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane) with MolForge

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Related Compounds

N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide
CID 165085933
[(2S,6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(2S,6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(2S,6R)-4-[[(2S,6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(2S,6R)-4-[[(2S,6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(6-benzamidopurin-9-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methyl benzoate
CID 171544486
methyl 2-[(2S,6R)-4-[[(2S,6R)-4-[[(2S,6R)-4-[[(2S,6R)-4-[[(2S,6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[2-(2-methylpropanoylamino)-6-oxo-1H-purin-9-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[2-(2-methylpropanoylamino)-6-oxo-1H-purin-9-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]benzoate
CID 176897703
1-[6-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-tritylmorpholin-2-yl]-5-methylpyrimidine-2,4-dione;N-[1-[6-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-tritylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[9-[6-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-tritylmorpholin-2-yl]purin-6-yl]benzamide;methane
CID 157076337
N-[1-[(2R,6S)-4-[[(2S,6R)-6-(6-benzamidopurin-9-yl)-4-[[(2R,3S,5R)-3-[tert-butyl(dimethyl)silyl]oxy-5-[5-(2-methylpropanoylamino)-7-oxo-6H-imidazo[4,5-b]pyridin-3-yl]oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[[[(2S,6R)-2-[[[(2R,6R)-2-(6-benzamidopurin-9-yl)-6-ethylmorpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]-6-[5-(2-methylpropanoylamino)-7-oxo-6H-imidazo[4,5-b]pyridin-3-yl]morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]morpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide
CID 165065067
N-[1-[(6S)-6-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-methylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide
CID 135295878
[(2S,6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(2S,6R)-6-(6-benzamidopurin-9-yl)-4-tritylmorpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methylphosphonic acid
CID 166099186
1-[(2R,6S)-6-[[[(2S,6R)-2-[[[(2R,6S)-2-(2-amino-6-oxo-1H-purin-9-yl)-6-[[[(2S,6R)-2-[[[(2R,6S)-2-(2-amino-6-oxo-1H-purin-9-yl)-6-[[[(2R,6S)-2-(2-amino-6-oxo-1H-purin-9-yl)-6-[[[(2R,6S)-2-(6-aminopurin-9-yl)-6-[[[(2R,6S)-2-(6-aminopurin-9-yl)-6-[[dimethylamino(methyl)phosphoryl]oxymethyl]morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-4-yl]-(dimethylamino)phosphoryl]oxymethyl]-4-[[(2S,6R)-6-(4-amino-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]-5-methylpyrimidine-2,4-dione
CID 167357120
1-[(2R)-4-[[(6R)-4-[[(6R)-4-[[(6R)-6-(2-amino-6-oxo-1H-purin-9-yl)-4-[[(6R)-6-(2-amino-6-oxo-1H-purin-9-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-6-(2-amino-6-oxo-1H-purin-9-yl)-4-[dimethylamino(methoxy)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(4-amino-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(6-aminopurin-9-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(4-amino-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-5-methylpyrimidine-2,4-dione
CID 176645184
2-[2-(2-hydroxyethoxy)ethoxy]ethyl 4-[[4-[[4-[[6-(2-amino-6-oxo-1H-purin-9-yl)-4-[[4-[[4-[[6-(4-amino-2-oxopyrimidin-1-yl)-4-[[6-(4-amino-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(4-amino-2-oxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]piperazine-1-carboxylate
CID 155093787
methyl 2-[(2S,6R)-4-[dimethylamino-[[(2S,6R)-4-[dimethylamino-[[(2S,6R)-4-[dimethylamino-[[(2S,6R)-6-[2-(2-methylpropylamino)-6-oxo-1H-purin-9-yl]-4-tritylmorpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[2-(2-methylpropylamino)-6-oxo-1H-purin-9-yl]morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]benzoate
CID 176888344
N-[9-[(6S)-6-[[dimethylamino-[(2R)-2-ethyl-6-(5-methyl-2-oxo-1,6-dihydropyrimidin-3-yl)morpholin-4-yl]phosphoryl]oxymethyl]morpholin-2-yl]purin-6-yl]benzamide
CID 135295909

Frequently Asked Questions

What is the IUPAC name of N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)?
The IUPAC name of N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane) (CID 165078420) is N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane).
What is the SMILES notation for N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)?
The canonical SMILES for N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane) is CC[C@@H]1CN([P@@](=O)(OCC2CN([P@@](=O)(OCC3CN([P@@](=O)(OCC4CN([P@@](=O)(OCC5CNC[C@H](n6cc(C)c(=O)[nH]c6=O)O5)N(C)C)C[C@H](n5cc(C)c(=O)[nH]c5=O)O4)N(C)C)C[C@H](n4cnc5c4C=C(NCC(C)C)CC5=O)O3)N(C)C)C[C@H](n3ccc(NC(=O)c4ccccc4)nc3=O)O2)N(C)C)C[C@H](n2ccc(NC(=O)c3ccccc3)nc2=O)O1.S.S.S.S.S.S.S.S.[2H][C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(Cl)N(C)C.[2H][C@H]1C[C@H](n2cc(C)c(=O)[nH]c2=O)OC1COP(=O)(N(C)C)N1CC(CO[P@@](=O)(N(C)C)N2CC(CO[P@@](=O)(N(C)C)N3CC(CO[P@@](=O)(N(C)C)N4CC(CO[P@@](=O)(N(C)C)N5C[C@@H](CC)O[C@@H](n6ccc(NC(=O)c7ccccc7)nc6=O)C5)O[C@@H](n5ccc(NC(=O)c6ccccc6)nc5=O)C4)O[C@@H](n4cnc5c4C=C(NCC(C)C)CC5=O)C3)O[C@@H](n3cc(C)c(=O)[nH]c3=O)C2)O[C@@H](n2cc(C)c(=O)[nH]c2=O)C1.[3H]OC.[3H]OC.
What is the InChIKey of N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)?
The InChIKey is USDYXLYOQHWBLY-NCFOOAOVSA-N. The full InChI is InChI=1S/C89H126N25O27P5.C77H108N22O22P4.C12H19ClN3O5P.2CH4O.8H2S/c1-17-63-40-104(45-74(136-63)109-32-30-71(94-85(109)121)92-83(119)60-24-20-18-21-25-60)142(126,99(7)8)132-51-65-41-105(46-75(138-65)110-33-31-72(95-86(110)122)93-84(120)61-26-22-19-23-27-61)144(128,101(11)12)135-54-68-44-108(49-78(141-68)114-55-91-79-69(114)34-62(35-70(79)115)90-36-56(2)3)146(130,103(15)16)134-53-67-43-107(48-77(140-67)113-39-59(6)82(118)98-89(113)125)145(129,102(13)14)133-52-66-42-106(47-76(139-66)112-38-58(5)81(117)97-88(112)124)143(127,100(9)10)131-50-64-28-29-73(137-64)111-37-57(4)80(116)96-87(111)123;1-14-55-36-91(40-65(117-55)95-27-25-62(83-74(95)105)81-72(103)52-21-17-15-18-22-52)122(109,87(6)7)114-45-57-37-92(41-66(119-57)96-28-26-63(84-75(96)106)82-73(104)53-23-19-16-20-24-53)124(111,89(10)11)116-47-59-39-94(43-68(121-59)99-48-80-69-60(99)29-54(30-61(69)100)79-31-49(2)3)125(112,90(12)13)115-46-58-38-93(42-67(120-58)98-35-51(5)71(102)86-77(98)108)123(110,88(8)9)113-44-56-32-78-33-64(118-56)97-34-50(4)70(101)85-76(97)107;1-8-6-16(12(18)14-11(8)17)10-5-4-9(21-10)7-20-22(13,19)15(2)3;2*1-2;;;;;;;;/h18-27,30-34,37-39,55-56,63-68,73-78,90H,17,28-29,35-36,40-54H2,1-16H3,(H,96,116,123)(H,97,117,124)(H,98,118,125)(H,92,94,119,121)(H,93,95,120,122);15-29,34-35,48-49,55-59,64-68,78-79H,14,30-33,36-47H2,1-13H3,(H,85,101,107)(H,86,102,108)(H,81,83,103,105)(H,82,84,104,106);6,9-10H,4-5,7H2,1-3H3,(H,14,17,18);2*2H,1H3;8*1H2/t63-,64?,65?,66?,67?,68?,73-,74-,75-,76-,77-,78-,142+,143?,144+,145+,146+;55-,56?,57?,58?,59?,64-,65-,66-,67-,68-,122+,123+,124+,125+;9?,10-,22?;;;;;;;;;;/m111........../s1/i28D;;4D;2*2T;;;;;;;;/t28-,63+,64?,65?,66?,67?,68?,73+,74+,75+,76+,77+,78+,142-,143?,144-,145-,146-;m;4-,9?,10+,22?;;;;;;;;;;/m010...........
What are the key properties of N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane)?
N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane) has a molecular weight of 4645.25 g/mol, XLogP of 10.96, 77 rotatable bonds, 15 hydrogen bond donors, and 77 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[[(6R)-4-[[(6R)-4-[[(6R)-4-[[(3S,5R)-3-deuterio-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;N-[1-[(2R,6R)-4-[[(6R)-6-(4-benzamido-2-oxopyrimidin-1-yl)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-4-[dimethylamino-[[(6R)-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-(5-methyl-2,4-dioxopyrimidin-1-yl)morpholin-2-yl]methoxy]phosphoryl]-6-[6-(2-methylpropylamino)-4-oxo-5H-benzimidazol-1-yl]morpholin-2-yl]methoxy]phosphoryl]morpholin-2-yl]methoxy-(dimethylamino)phosphoryl]-6-ethylmorpholin-2-yl]-2-oxopyrimidin-4-yl]benzamide;1-[(2R,4S)-5-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-deuteriooxolan-2-yl]-5-methylpyrimidine-2,4-dione;sulfane;bis(tritiooxymethane) is sourced from PubChem (CID 165078420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).