[(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium

C183H245Br5I7N39O37V3-3 — CID 160961885

IUPAC[(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium
SMILESBrc1cn2ccnc2c(Br)n1.C.CC.CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1cncc(Br)n1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CC(C)(C)OC(=O)OC[C@H]1CN(c2ccc(N(C(=O)OC(C)(C)C)c3nc(-c4cncc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)n4)cn4ccnc34)cc2)CCO1.CC(C)(C)OC(=O)OC[C@H]1CN(c2ccc(N(C(=O)OC(C)(C)C)c3nc(Br)cn4ccnc34)cc2)CCO1.CCI.Cc1cn2ccnc2c(N(C(=O)OC(C)(C)C)c2ccc(N3CCO[C@@H](COC(=O)OC(C)(C)C)C3)cc2)n1.I[V](I)I.I[V]I.Nc1ccc(N2CCO[C@@H](CO)C2)cc1.Nc1cncc(-c2cn3ccnc3c(Nc3ccc(N4CCO[C@@H](CO)C4)cc3)n2)n1.OC[C@H]1CN(c2ccc(Nc3nc(Br)cn4ccnc34)cc2)CCO1.[CH2-]I.[CH3-].[CH3-].[V]
InChIInChI=1S/C41H54N8O10.C28H37N5O6.C27H34BrN5O6.C21H22N8O2.C17H18BrN5O2.C14H20BrN3O4.C11H16N2O2.C10H18O5.C6H3Br2N3.C2H5I.C2H6.CH2I.CH4.2CH3.5HI.3V/c1-38(2,3)56-34(50)48(27-15-13-26(14-16-27)46-19-20-54-28(23-46)25-55-37(53)59-41(10,11)12)33-32-43-17-18-47(32)24-30(45-33)29-21-42-22-31(44-29)49(35(51)57-39(4,5)6)36(52)58-40(7,8)9;1-19-16-32-13-12-29-23(32)24(30-19)33(25(34)38-27(2,3)4)21-10-8-20(9-11-21)31-14-15-36-22(17-31)18-37-26(35)39-28(5,6)7;1-26(2,3)38-24(34)33(23-22-29-11-12-32(22)16-21(28)30-23)19-9-7-18(8-10-19)31-13-14-36-20(15-31)17-37-25(35)39-27(4,5)6;22-19-10-23-9-17(26-19)18-12-29-6-5-24-21(29)20(27-18)25-14-1-3-15(4-2-14)28-7-8-31-16(11-28)13-30;18-15-10-23-6-5-19-17(23)16(21-15)20-12-1-3-13(4-2-12)22-7-8-25-14(9-22)11-24;1-13(2,3)21-11(19)18(12(20)22-14(4,5)6)10-8-16-7-9(15)17-10;12-9-1-3-10(4-2-9)13-5-6-15-11(7-13)8-14;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;7-4-3-11-2-1-9-6(11)5(8)10-4;1-2-3;2*1-2;;;;;;;;;;;/h13-18,21-22,24,28H,19-20,23,25H2,1-12H3;8-13,16,22H,14-15,17-18H2,1-7H3;7-12,16,20H,13-15,17H2,1-6H3;1-6,9-10,12,16,30H,7-8,11,13H2,(H2,22,26)(H,25,27);1-6,10,14,24H,7-9,11H2,(H,20,21);7-8H,1-6H3;1-4,11,14H,5-8,12H2;1-6H3;1-3H;2H2,1H3;1-2H3;1H2;1H4;2*1H3;5*1H;;;/q;;;;;;;;;;;-1;;2*-1;;;;;;;+2;+3/p-5/t28-;22-;20-;16-;14-;;11-;;;;;;;;;;;;;;;;/m11111.1................/s1
InChIKeyBNZAGYUKTSBCHA-PXSLJUPVSA-I
MW5023.89 g/mol
LogP42.37
Rot. Bonds29

About [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium

[(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium (PubChem CID 160961885) has the molecular formula C183H245Br5I7N39O37V3-3 and a molecular weight of 5023.89 g/mol. Its IUPAC name is [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium.

Molecular Properties

Compound Name[(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium
PubChem CID160961885
Molecular FormulaC183H245Br5I7N39O37V3-3
Molecular Weight5023.89 g/mol
Exact Mass5016.61
IUPAC Name[(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium
SMILESBrc1cn2ccnc2c(Br)n1.C.CC.CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1cncc(Br)n1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CC(C)(C)OC(=O)OC[C@H]1CN(c2ccc(N(C(=O)OC(C)(C)C)c3nc(-c4cncc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)n4)cn4ccnc34)cc2)CCO1.CC(C)(C)OC(=O)OC[C@H]1CN(c2ccc(N(C(=O)OC(C)(C)C)c3nc(Br)cn4ccnc34)cc2)CCO1.CCI.Cc1cn2ccnc2c(N(C(=O)OC(C)(C)C)c2ccc(N3CCO[C@@H](COC(=O)OC(C)(C)C)C3)cc2)n1.I[V](I)I.I[V]I.Nc1ccc(N2CCO[C@@H](CO)C2)cc1.Nc1cncc(-c2cn3ccnc3c(Nc3ccc(N4CCO[C@@H](CO)C4)cc3)n2)n1.OC[C@H]1CN(c2ccc(Nc3nc(Br)cn4ccnc34)cc2)CCO1.[CH2-]I.[CH3-].[CH3-].[V]
InChIInChI=1S/C41H54N8O10.C28H37N5O6.C27H34BrN5O6.C21H22N8O2.C17H18BrN5O2.C14H20BrN3O4.C11H16N2O2.C10H18O5.C6H3Br2N3.C2H5I.C2H6.CH2I.CH4.2CH3.5HI.3V/c1-38(2,3)56-34(50)48(27-15-13-26(14-16-27)46-19-20-54-28(23-46)25-55-37(53)59-41(10,11)12)33-32-43-17-18-47(32)24-30(45-33)29-21-42-22-31(44-29)49(35(51)57-39(4,5)6)36(52)58-40(7,8)9;1-19-16-32-13-12-29-23(32)24(30-19)33(25(34)38-27(2,3)4)21-10-8-20(9-11-21)31-14-15-36-22(17-31)18-37-26(35)39-28(5,6)7;1-26(2,3)38-24(34)33(23-22-29-11-12-32(22)16-21(28)30-23)19-9-7-18(8-10-19)31-13-14-36-20(15-31)17-37-25(35)39-27(4,5)6;22-19-10-23-9-17(26-19)18-12-29-6-5-24-21(29)20(27-18)25-14-1-3-15(4-2-14)28-7-8-31-16(11-28)13-30;18-15-10-23-6-5-19-17(23)16(21-15)20-12-1-3-13(4-2-12)22-7-8-25-14(9-22)11-24;1-13(2,3)21-11(19)18(12(20)22-14(4,5)6)10-8-16-7-9(15)17-10;12-9-1-3-10(4-2-9)13-5-6-15-11(7-13)8-14;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;7-4-3-11-2-1-9-6(11)5(8)10-4;1-2-3;2*1-2;;;;;;;;;;;/h13-18,21-22,24,28H,19-20,23,25H2,1-12H3;8-13,16,22H,14-15,17-18H2,1-7H3;7-12,16,20H,13-15,17H2,1-6H3;1-6,9-10,12,16,30H,7-8,11,13H2,(H2,22,26)(H,25,27);1-6,10,14,24H,7-9,11H2,(H,20,21);7-8H,1-6H3;1-4,11,14H,5-8,12H2;1-6H3;1-3H;2H2,1H3;1-2H3;1H2;1H4;2*1H3;5*1H;;;/q;;;;;;;;;;;-1;;2*-1;;;;;;;+2;+3/p-5/t28-;22-;20-;16-;14-;;11-;;;;;;;;;;;;;;;;/m11111.1................/s1
InChIKeyBNZAGYUKTSBCHA-PXSLJUPVSA-I
XLogP42.37
TPSA838.81 Ų
H-Bond Donors7
H-Bond Acceptors71
Rotatable Bonds29
Heavy Atoms274
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005023.89
LogP ≤ 542.37
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1071

Analyze [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium with MolForge

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Frequently Asked Questions

What is the IUPAC name of [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium?
The IUPAC name of [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium (CID 160961885) is [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium.
What is the SMILES notation for [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium?
The canonical SMILES for [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium is Brc1cn2ccnc2c(Br)n1.C.CC.CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1cncc(Br)n1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CC(C)(C)OC(=O)OC[C@H]1CN(c2ccc(N(C(=O)OC(C)(C)C)c3nc(-c4cncc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)n4)cn4ccnc34)cc2)CCO1.CC(C)(C)OC(=O)OC[C@H]1CN(c2ccc(N(C(=O)OC(C)(C)C)c3nc(Br)cn4ccnc34)cc2)CCO1.CCI.Cc1cn2ccnc2c(N(C(=O)OC(C)(C)C)c2ccc(N3CCO[C@@H](COC(=O)OC(C)(C)C)C3)cc2)n1.I[V](I)I.I[V]I.Nc1ccc(N2CCO[C@@H](CO)C2)cc1.Nc1cncc(-c2cn3ccnc3c(Nc3ccc(N4CCO[C@@H](CO)C4)cc3)n2)n1.OC[C@H]1CN(c2ccc(Nc3nc(Br)cn4ccnc34)cc2)CCO1.[CH2-]I.[CH3-].[CH3-].[V].
What is the InChIKey of [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium?
The InChIKey is BNZAGYUKTSBCHA-PXSLJUPVSA-I. The full InChI is InChI=1S/C41H54N8O10.C28H37N5O6.C27H34BrN5O6.C21H22N8O2.C17H18BrN5O2.C14H20BrN3O4.C11H16N2O2.C10H18O5.C6H3Br2N3.C2H5I.C2H6.CH2I.CH4.2CH3.5HI.3V/c1-38(2,3)56-34(50)48(27-15-13-26(14-16-27)46-19-20-54-28(23-46)25-55-37(53)59-41(10,11)12)33-32-43-17-18-47(32)24-30(45-33)29-21-42-22-31(44-29)49(35(51)57-39(4,5)6)36(52)58-40(7,8)9;1-19-16-32-13-12-29-23(32)24(30-19)33(25(34)38-27(2,3)4)21-10-8-20(9-11-21)31-14-15-36-22(17-31)18-37-26(35)39-28(5,6)7;1-26(2,3)38-24(34)33(23-22-29-11-12-32(22)16-21(28)30-23)19-9-7-18(8-10-19)31-13-14-36-20(15-31)17-37-25(35)39-27(4,5)6;22-19-10-23-9-17(26-19)18-12-29-6-5-24-21(29)20(27-18)25-14-1-3-15(4-2-14)28-7-8-31-16(11-28)13-30;18-15-10-23-6-5-19-17(23)16(21-15)20-12-1-3-13(4-2-12)22-7-8-25-14(9-22)11-24;1-13(2,3)21-11(19)18(12(20)22-14(4,5)6)10-8-16-7-9(15)17-10;12-9-1-3-10(4-2-9)13-5-6-15-11(7-13)8-14;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;7-4-3-11-2-1-9-6(11)5(8)10-4;1-2-3;2*1-2;;;;;;;;;;;/h13-18,21-22,24,28H,19-20,23,25H2,1-12H3;8-13,16,22H,14-15,17-18H2,1-7H3;7-12,16,20H,13-15,17H2,1-6H3;1-6,9-10,12,16,30H,7-8,11,13H2,(H2,22,26)(H,25,27);1-6,10,14,24H,7-9,11H2,(H,20,21);7-8H,1-6H3;1-4,11,14H,5-8,12H2;1-6H3;1-3H;2H2,1H3;1-2H3;1H2;1H4;2*1H3;5*1H;;;/q;;;;;;;;;;;-1;;2*-1;;;;;;;+2;+3/p-5/t28-;22-;20-;16-;14-;;11-;;;;;;;;;;;;;;;;/m11111.1................/s1.
What are the key properties of [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium?
[(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium has a molecular weight of 5023.89 g/mol, XLogP of 42.37, 29 rotatable bonds, 7 hydrogen bond donors, and 71 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4-(4-aminophenyl)morpholin-2-yl]methanol;[(2R)-4-[4-[[6-(6-aminopyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[[6-[6-[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]pyrazin-2-yl]imidazo[1,2-a]pyrazin-8-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol;[(2R)-4-[4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl tert-butyl carbonate;tert-butyl N-(6-bromopyrazin-2-yl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate;tert-butyl [(2R)-4-[4-[(6-methylimidazo[1,2-a]pyrazin-8-yl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenyl]morpholin-2-yl]methyl carbonate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;carbanide;6,8-dibromoimidazo[1,2-a]pyrazine;diiodovanadium;ethane;iodoethane;iodomethane;methane;triiodovanadium;vanadium is sourced from PubChem (CID 160961885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).