2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine

C128H81N17O4 — CID 157065140

IUPAC2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4o3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4o3)nc2)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc4ncccc4o3)nc2)cc1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cn3)oc2c1
InChIInChI=1S/C36H23N3O.C35H23N5O.C35H22N4O.C22H13N5O/c1-3-8-24(9-4-1)27-15-19-32-30(22-27)31-23-28(25-10-5-2-6-11-25)16-20-33(31)39(32)29-17-13-26(14-18-29)36-38-35-34(40-36)12-7-21-37-35;1-3-10-24(11-4-1)39(25-12-5-2-6-13-25)26-18-20-32-29(22-26)28-14-7-8-15-31(28)40(32)27-17-19-30(37-23-27)35-38-34-33(41-35)16-9-21-36-34;1-3-8-23(9-4-1)25-13-17-31-28(20-25)29-21-26(24-10-5-2-6-11-24)14-18-32(29)39(31)27-15-16-30(37-22-27)35-38-34-33(40-35)12-7-19-36-34;1-2-7-18-15(5-1)16-6-3-12-24-21(16)27(18)14-9-10-17(25-13-14)22-26-20-19(28-22)8-4-11-23-20/h1-23H;1-23H;1-22H;1-13H
InChIKeyABUDRUHSLUTGIH-UHFFFAOYSA-N
MW1921.17 g/mol
LogP31.67
Rot. Bonds15

About 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine

2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine (PubChem CID 157065140) has the molecular formula C128H81N17O4 and a molecular weight of 1921.17 g/mol. Its IUPAC name is 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine
PubChem CID157065140
Molecular FormulaC128H81N17O4
Molecular Weight1921.17 g/mol
Exact Mass1919.67
IUPAC Name2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4o3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4o3)nc2)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc4ncccc4o3)nc2)cc1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cn3)oc2c1
InChIInChI=1S/C36H23N3O.C35H23N5O.C35H22N4O.C22H13N5O/c1-3-8-24(9-4-1)27-15-19-32-30(22-27)31-23-28(25-10-5-2-6-11-25)16-20-33(31)39(32)29-17-13-26(14-18-29)36-38-35-34(40-36)12-7-21-37-35;1-3-10-24(11-4-1)39(25-12-5-2-6-13-25)26-18-20-32-29(22-26)28-14-7-8-15-31(28)40(32)27-17-19-30(37-23-27)35-38-34-33(41-35)16-9-21-36-34;1-3-8-23(9-4-1)25-13-17-31-28(20-25)29-21-26(24-10-5-2-6-11-24)14-18-32(29)39(31)27-15-16-30(37-22-27)35-38-34-33(40-35)12-7-19-36-34;1-2-7-18-15(5-1)16-6-3-12-24-21(16)27(18)14-9-10-17(25-13-14)22-26-20-19(28-22)8-4-11-23-20/h1-23H;1-23H;1-22H;1-13H
InChIKeyABUDRUHSLUTGIH-UHFFFAOYSA-N
XLogP31.67
TPSA230.20 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds15
Heavy Atoms149
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001921.17
LogP ≤ 531.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Analyze 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine with MolForge

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Related Compounds

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CID 144912177
2-[4-[1-[6-[7-[4-[1-(2-methoxyethyl)-4-(trifluoromethyl)imidazol-2-yl]phenyl]-1-(2-propan-2-yl-3-pyridinyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]-2-propan-2-yl-3-pyridinyl]-3-[[5-[3-methyl-7-[4-(triazol-2-yl)phenyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-1-yl]-6-propan-2-yl-2-pyridinyl]methyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl]phenyl]-5-methyl-1,3-oxazole
CID 153629252
2-(1-fluorocarbazol-9-yl)-N-[4-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]aniline
CID 156206374
N-[2-(1-fluorocarbazol-9-yl)phenyl]-6-([1,3]oxazolo[4,5-b]pyridin-2-yl)pyridin-3-amine
CID 156206375
5-[3-(4,4-difluoropiperidin-1-yl)pyrido[2,3-b]pyrazin-6-yl]-2-methyl-1,3-benzoxazole;2-methyl-5-[3-[3-(2-methylmorpholin-4-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazole;2-methyl-5-[3-[(3R)-3-methylmorpholin-4-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazole;2-methyl-5-[3-[(3S)-3-methylmorpholin-4-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazole;2-methyl-5-[3-[3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)azetidin-1-yl]pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazole;2-methyl-5-[3-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)pyrido[2,3-b]pyrazin-6-yl]-1,3-benzoxazole;2-methyl-5-(3-pyridin-3-ylpyrido[2,3-b]pyrazin-6-yl)-1,3-benzoxazole
CID 157232728
(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
1-benzyl-6-[4-(trifluoromethoxy)phenyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;N,N-diethyl-2-[2-oxo-5-[4-(trifluoromethoxy)phenyl]-1,3-benzoxazol-3-yl]acetamide;3-(2,2-difluoropropyl)-1-methyl-5-[4-(trifluoromethoxy)phenyl]benzimidazol-2-one;3-(2,2-difluoropropyl)-5-[4-(trifluoromethoxy)phenyl]-[1,3]oxazolo[4,5-b]pyridin-2-one;N,N-dimethyl-2-[2-oxo-5-[4-(trifluoromethoxy)phenyl]-1,3-benzoxazol-3-yl]acetamide;3-(2-pyrimidin-2-ylethyl)-5-[4-(trifluoromethoxy)phenyl]-1,3-benzoxazol-2-one;5-[4-(trifluoromethoxy)phenyl]-3H-furo[2,3-b]pyridin-2-one;5-[4-(trifluoromethoxy)phenyl]-3H-furo[2,3-c]pyridin-2-one
CID 157515725
8-[1-(2-tert-butyl-4-phenylphenyl)benzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(2,6-dimethyl-4-phenylphenyl)benzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(iridium);8-[1-[4-phenyl-2,6-di(propan-2-yl)phenyl]benzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;8-[1-(4-phenylphenyl)benzimidazol-2-yl]-2-(trifluoromethyl)-7H-[1]benzofuro[2,3-b]pyridin-7-ide;tetrakis(trimethyl-[4-(2-methylpropyl)-6-phenyl-3-pyridinyl]germane)
CID 157633979
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-6,12-dimorpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
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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
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-12-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158885713

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine?
The IUPAC name of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine (CID 157065140) is 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine.
What is the SMILES notation for 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine?
The canonical SMILES for 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4o3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4o3)nc2)cc1.c1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3nc4ncccc4o3)nc2)cc1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cn3)oc2c1.
What is the InChIKey of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine?
The InChIKey is ABUDRUHSLUTGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23N3O.C35H23N5O.C35H22N4O.C22H13N5O/c1-3-8-24(9-4-1)27-15-19-32-30(22-27)31-23-28(25-10-5-2-6-11-25)16-20-33(31)39(32)29-17-13-26(14-18-29)36-38-35-34(40-36)12-7-21-37-35;1-3-10-24(11-4-1)39(25-12-5-2-6-13-25)26-18-20-32-29(22-26)28-14-7-8-15-31(28)40(32)27-17-19-30(37-23-27)35-38-34-33(41-35)16-9-21-36-34;1-3-8-23(9-4-1)25-13-17-31-28(20-25)29-21-26(24-10-5-2-6-11-24)14-18-32(29)39(31)27-15-16-30(37-22-27)35-38-34-33(40-35)12-7-19-36-34;1-2-7-18-15(5-1)16-6-3-12-24-21(16)27(18)14-9-10-17(25-13-14)22-26-20-19(28-22)8-4-11-23-20/h1-23H;1-23H;1-22H;1-13H.
What are the key properties of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine?
2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine has a molecular weight of 1921.17 g/mol, XLogP of 31.67, 15 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]oxazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]oxazolo[4,5-b]pyridine;9-[6-([1,3]oxazolo[4,5-b]pyridin-2-yl)-3-pyridinyl]-N,N-diphenylcarbazol-3-amine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]oxazolo[4,5-b]pyridine is sourced from PubChem (CID 157065140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).