2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine

C204H116N40O8 — CID 157188480

IUPAC2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine
SMILESc1ccc(-n2c(-c3cc(-c4cc(-c5cc(-c6nc7cccnc7n6-c6ccccc6)cc(-c6nc7cccnc7n6-c6ccccc6)c5)c(-c5cc(-c6nc7cccnc7n6-c6ccccc6)cc(-c6nc7cccnc7n6-c6ccccc6)c5)cc4-c4cc(-c5nc6cccnc6n5-c5ccccc5)cc(-c5nc6cccnc6n5-c5ccccc5)c4)cc(-c4nc5cccnc5n4-c4ccccc4)c3)nc3cccnc32)cc1.c1cnc2oc(-c3cc(-c4nc5cccnc5o4)cc(-c4cc(-c5cc(-c6nc7cccnc7o6)cc(-c6nc7cccnc7o6)c5)c(-c5cc(-c6nc7cccnc7o6)cc(-c6nc7cccnc7o6)c5)cc4-c4cc(-c5nc6cccnc6o5)cc(-c5nc6cccnc6o5)c4)c3)nc2c1
InChIInChI=1S/C126H78N24.C78H38N16O8/c1-9-33-91(34-10-1)143-111(135-103-49-25-57-127-119(103)143)83-65-79(66-84(73-83)112-136-104-50-26-58-128-120(104)144(112)92-35-11-2-12-36-92)99-77-101(81-69-87(115-139-107-53-29-61-131-123(107)147(115)95-41-17-5-18-42-95)75-88(70-81)116-140-108-54-30-62-132-124(108)148(116)96-43-19-6-20-44-96)102(82-71-89(117-141-109-55-31-63-133-125(109)149(117)97-45-21-7-22-46-97)76-90(72-82)118-142-110-56-32-64-134-126(110)150(118)98-47-23-8-24-48-98)78-100(99)80-67-85(113-137-105-51-27-59-129-121(105)145(113)93-37-13-3-14-38-93)74-86(68-80)114-138-106-52-28-60-130-122(106)146(114)94-39-15-4-16-40-94;1-9-55-71(79-17-1)95-63(87-55)43-25-39(26-44(33-43)64-88-56-10-2-18-80-72(56)96-64)51-37-53(41-29-47(67-91-59-13-5-21-83-75(59)99-67)35-48(30-41)68-92-60-14-6-22-84-76(60)100-68)54(42-31-49(69-93-61-15-7-23-85-77(61)101-69)36-50(32-42)70-94-62-16-8-24-86-78(62)102-70)38-52(51)40-27-45(65-89-57-11-3-19-81-73(57)97-65)34-46(28-40)66-90-58-12-4-20-82-74(58)98-66/h1-78H;1-38H
InChIKeyAPKJHPLAZUGUNV-UHFFFAOYSA-N
MW3255.44 g/mol
LogP45.54
Rot. Bonds32

About 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine

2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine (PubChem CID 157188480) has the molecular formula C204H116N40O8 and a molecular weight of 3255.44 g/mol. Its IUPAC name is 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine
PubChem CID157188480
Molecular FormulaC204H116N40O8
Molecular Weight3255.44 g/mol
Exact Mass3252.99
IUPAC Name2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine
SMILESc1ccc(-n2c(-c3cc(-c4cc(-c5cc(-c6nc7cccnc7n6-c6ccccc6)cc(-c6nc7cccnc7n6-c6ccccc6)c5)c(-c5cc(-c6nc7cccnc7n6-c6ccccc6)cc(-c6nc7cccnc7n6-c6ccccc6)c5)cc4-c4cc(-c5nc6cccnc6n5-c5ccccc5)cc(-c5nc6cccnc6n5-c5ccccc5)c4)cc(-c4nc5cccnc5n4-c4ccccc4)c3)nc3cccnc32)cc1.c1cnc2oc(-c3cc(-c4nc5cccnc5o4)cc(-c4cc(-c5cc(-c6nc7cccnc7o6)cc(-c6nc7cccnc7o6)c5)c(-c5cc(-c6nc7cccnc7o6)cc(-c6nc7cccnc7o6)c5)cc4-c4cc(-c5nc6cccnc6o5)cc(-c5nc6cccnc6o5)c4)c3)nc2c1
InChIInChI=1S/C126H78N24.C78H38N16O8/c1-9-33-91(34-10-1)143-111(135-103-49-25-57-127-119(103)143)83-65-79(66-84(73-83)112-136-104-50-26-58-128-120(104)144(112)92-35-11-2-12-36-92)99-77-101(81-69-87(115-139-107-53-29-61-131-123(107)147(115)95-41-17-5-18-42-95)75-88(70-81)116-140-108-54-30-62-132-124(108)148(116)96-43-19-6-20-44-96)102(82-71-89(117-141-109-55-31-63-133-125(109)149(117)97-45-21-7-22-46-97)76-90(72-82)118-142-110-56-32-64-134-126(110)150(118)98-47-23-8-24-48-98)78-100(99)80-67-85(113-137-105-51-27-59-129-121(105)145(113)93-37-13-3-14-38-93)74-86(68-80)114-138-106-52-28-60-130-122(106)146(114)94-39-15-4-16-40-94;1-9-55-71(79-17-1)95-63(87-55)43-25-39(26-44(33-43)64-88-56-10-2-18-80-72(56)96-64)51-37-53(41-29-47(67-91-59-13-5-21-83-75(59)99-67)35-48(30-41)68-92-60-14-6-22-84-76(60)100-68)54(42-31-49(69-93-61-15-7-23-85-77(61)101-69)36-50(32-42)70-94-62-16-8-24-86-78(62)102-70)38-52(51)40-27-45(65-89-57-11-3-19-81-73(57)97-65)34-46(28-40)66-90-58-12-4-20-82-74(58)98-66/h1-78H;1-38H
InChIKeyAPKJHPLAZUGUNV-UHFFFAOYSA-N
XLogP45.54
TPSA557.04 Ų
H-Bond Donors
H-Bond Acceptors48
Rotatable Bonds32
Heavy Atoms252
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003255.44
LogP ≤ 545.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1048

Analyze 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine with MolForge

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Related Compounds

(4,4-difluoropiperidin-1-yl)-[6-(2-methyl-1-benzofuran-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[3-(3,3-difluoropyrrolidin-1-yl)azetidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[3-(3,3-difluoropyrrolidin-1-yl)pyrrolidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[3-[(3R)-3,4-dimethylpiperazin-1-yl]azetidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;(4-fluoropiperidin-1-yl)-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone
CID 157242209
2-[4-[9,9-Dihexyl-7-[4-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[5-[9,9-dimethyl-7-[2-methyl-6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]fluoren-2-yl]-6-methyl-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[4-[9,9-dimethyl-7-[4-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[4-[9,9-dimethyl-7-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-methyl-5-[7-[2-methyl-6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine
CID 158312442
(4,4-Difluoropiperidin-1-yl)-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[3-(3,3-difluoropyrrolidin-1-yl)azetidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[3-(3,3-difluoropyrrolidin-1-yl)pyrrolidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;(4-fluoropiperidin-1-yl)-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)methanone
CID 158954770
2-[3-[9,9-Dihexyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[6-[9,9-dimethyl-7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]fluoren-2-yl]-2-pyridinyl]-5-methyl-[1,3]oxazolo[4,5-b]pyridine;2-[3-[9,9-dimethyl-7-[3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]fluoren-2-yl]phenyl]-[1,3]oxazolo[4,5-b]pyridine;5-methyl-2-[6-[7-[6-(5-methyl-[1,3]oxazolo[4,5-b]pyridin-2-yl)-2-pyridinyl]-9,9-bis(trifluoromethyl)fluoren-2-yl]-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine
CID 159148825
CID 159377111
CID 159377111
5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethoxy)benzamide;5-[3-(2,3-difluorophenyl)imidazo[1,5-a]pyridin-8-yl]-N-(4-methylphenyl)-2-(trifluoromethyl)benzamide;2-methyl-N-(4-methylphenyl)-5-[3-(1,3-oxazol-2-yl)imidazo[1,5-a]pyridin-8-yl]benzamide;N-(4-methylphenyl)-5-(3-pyrimidin-2-ylimidazo[1,5-a]pyridin-8-yl)-2-(trifluoromethyl)benzamide
CID 160392530
CID 160519109
CID 160519109
[3-(3,3-difluoroazetidin-1-yl)pyrrolidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(3R)-3-methylmorpholin-4-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(3S)-3-methylmorpholin-4-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(2R)-2-methylpyrrolidin-1-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(2S)-2-methylpyrrolidin-1-yl]methanone
CID 161320560
2-[2-(cyclopropylmethoxy)-3-pyridinyl]-7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-2-(2-propan-2-yl-3-pyridinyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-[[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-2-(2-propoxy-3-pyridinyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-[[4-(2-oxa-5-azaspiro[3.4]octane-5-carbonyl)phenyl]methyl]-2-(2-propan-2-ylphenyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one
CID 161369828
[3-(3,3-difluoroazetidin-1-yl)pyrrolidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;(4,4-difluoropiperidin-1-yl)-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[3-(3,3-difluoropyrrolidin-1-yl)pyrrolidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(3R)-3-methylmorpholin-4-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(3S)-3-methylmorpholin-4-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(2S)-2-methylpyrrolidin-1-yl]methanone
CID 162193269
[(2S)-2-[(5-ethylpyrimidin-2-yl)oxymethyl]pyrrolidin-1-yl]-(2-phenylimidazo[1,2-a]pyridin-3-yl)methanone;[(2S)-2-[(5-ethylpyrimidin-2-yl)oxymethyl]pyrrolidin-1-yl]-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)methanone;methane;[(2S)-2-[(5-methyl-2-pyridinyl)oxymethyl]pyrrolidin-1-yl]-(2-phenyl-6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazin-3-yl)methanone;[(2S)-2-[(5-methyl-2-pyridinyl)oxymethyl]pyrrolidin-1-yl]-(2-phenylimidazo[1,2-a]pyridin-3-yl)methanone;(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-[(2S)-2-[[5-(trifluoromethyl)-2-pyridinyl]oxymethyl]pyrrolidin-1-yl]methanone
CID 167626177
7-[[4-[5-(1,1-difluoroethyl)-1-methyl-1,2,4-triazol-3-yl]phenyl]methyl]-2-(2-propan-2-ylphenyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-[(4-imidazo[1,2-a]pyrazin-8-ylphenyl)methyl]-2-(2-propan-2-ylphenyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one;7-methyl-9-[[4-(4-methyl-1,3-oxazol-2-yl)phenyl]methyl]-2-(2-propan-2-ylphenyl)purin-8-one;7-[[4-(1-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)phenyl]methyl]-2-(2-propan-2-ylphenyl)-5H-pyrrolo[2,3-d]pyrimidin-6-one
CID 167665621

Frequently Asked Questions

What is the IUPAC name of 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine?
The IUPAC name of 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine (CID 157188480) is 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine?
The canonical SMILES for 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine is c1ccc(-n2c(-c3cc(-c4cc(-c5cc(-c6nc7cccnc7n6-c6ccccc6)cc(-c6nc7cccnc7n6-c6ccccc6)c5)c(-c5cc(-c6nc7cccnc7n6-c6ccccc6)cc(-c6nc7cccnc7n6-c6ccccc6)c5)cc4-c4cc(-c5nc6cccnc6n5-c5ccccc5)cc(-c5nc6cccnc6n5-c5ccccc5)c4)cc(-c4nc5cccnc5n4-c4ccccc4)c3)nc3cccnc32)cc1.c1cnc2oc(-c3cc(-c4nc5cccnc5o4)cc(-c4cc(-c5cc(-c6nc7cccnc7o6)cc(-c6nc7cccnc7o6)c5)c(-c5cc(-c6nc7cccnc7o6)cc(-c6nc7cccnc7o6)c5)cc4-c4cc(-c5nc6cccnc6o5)cc(-c5nc6cccnc6o5)c4)c3)nc2c1.
What is the InChIKey of 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine?
The InChIKey is APKJHPLAZUGUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C126H78N24.C78H38N16O8/c1-9-33-91(34-10-1)143-111(135-103-49-25-57-127-119(103)143)83-65-79(66-84(73-83)112-136-104-50-26-58-128-120(104)144(112)92-35-11-2-12-36-92)99-77-101(81-69-87(115-139-107-53-29-61-131-123(107)147(115)95-41-17-5-18-42-95)75-88(70-81)116-140-108-54-30-62-132-124(108)148(116)96-43-19-6-20-44-96)102(82-71-89(117-141-109-55-31-63-133-125(109)149(117)97-45-21-7-22-46-97)76-90(72-82)118-142-110-56-32-64-134-126(110)150(118)98-47-23-8-24-48-98)78-100(99)80-67-85(113-137-105-51-27-59-129-121(105)145(113)93-37-13-3-14-38-93)74-86(68-80)114-138-106-52-28-60-130-122(106)146(114)94-39-15-4-16-40-94;1-9-55-71(79-17-1)95-63(87-55)43-25-39(26-44(33-43)64-88-56-10-2-18-80-72(56)96-64)51-37-53(41-29-47(67-91-59-13-5-21-83-75(59)99-67)35-48(30-41)68-92-60-14-6-22-84-76(60)100-68)54(42-31-49(69-93-61-15-7-23-85-77(61)101-69)36-50(32-42)70-94-62-16-8-24-86-78(62)102-70)38-52(51)40-27-45(65-89-57-11-3-19-81-73(57)97-65)34-46(28-40)66-90-58-12-4-20-82-74(58)98-66/h1-78H;1-38H.
What are the key properties of 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine?
2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine has a molecular weight of 3255.44 g/mol, XLogP of 45.54, 32 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-([1,3]oxazolo[5,4-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis([1,3]oxazolo[5,4-b]pyridin-2-yl)phenyl]phenyl]phenyl]-[1,3]oxazolo[5,4-b]pyridine;3-phenyl-2-[3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-5-[2,4,5-tris[3,5-bis(3-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]phenyl]phenyl]imidazo[4,5-b]pyridine is sourced from PubChem (CID 157188480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).