2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine

C116H72N16S4 — CID 158961551

IUPAC2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4s3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4s3)nc2)cc1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cc3)sc2c1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cn3)sc2c1
InChIInChI=1S/C36H23N3S.C35H22N4S.C23H14N4S.C22H13N5S/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;1-3-8-23(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;1-2-7-19-17(5-1)18-6-3-14-25-22(18)27(19)16-11-9-15(10-12-16)23-26-21-20(28-23)8-4-13-24-21;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;1-22H;1-14H;1-13H
InChIKeyJMRMAJBOOZCRKN-UHFFFAOYSA-N
MW1818.23 g/mol
LogP30.07
Rot. Bonds12

About 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine

2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 158961551) has the molecular formula C116H72N16S4 and a molecular weight of 1818.23 g/mol. Its IUPAC name is 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine
PubChem CID158961551
Molecular FormulaC116H72N16S4
Molecular Weight1818.23 g/mol
Exact Mass1816.50
IUPAC Name2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine
SMILESc1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4s3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4s3)nc2)cc1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cc3)sc2c1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cn3)sc2c1
InChIInChI=1S/C36H23N3S.C35H22N4S.C23H14N4S.C22H13N5S/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;1-3-8-23(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;1-2-7-19-17(5-1)18-6-3-14-25-22(18)27(19)16-11-9-15(10-12-16)23-26-21-20(28-23)8-4-13-24-21;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;1-22H;1-14H;1-13H
InChIKeyJMRMAJBOOZCRKN-UHFFFAOYSA-N
XLogP30.07
TPSA174.40 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds12
Heavy Atoms136
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001818.23
LogP ≤ 530.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine (CID 158961551) is 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4s3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3nc4ncccc4s3)nc2)cc1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cc3)sc2c1.c1cnc2nc(-c3ccc(-n4c5ccccc5c5cccnc54)cn3)sc2c1.
What is the InChIKey of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is JMRMAJBOOZCRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23N3S.C35H22N4S.C23H14N4S.C22H13N5S/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;1-3-8-23(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;1-2-7-19-17(5-1)18-6-3-14-25-22(18)27(19)16-11-9-15(10-12-16)23-26-21-20(28-23)8-4-13-24-21;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;1-22H;1-14H;1-13H.
What are the key properties of 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine?
2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 1818.23 g/mol, XLogP of 30.07, 12 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-[1,3]thiazolo[4,5-b]pyridine;2-[5-(3,6-diphenylcarbazol-9-yl)-2-pyridinyl]-[1,3]thiazolo[4,5-b]pyridine;2-(4-pyrido[2,3-b]indol-9-ylphenyl)-[1,3]thiazolo[4,5-b]pyridine;2-(5-pyrido[2,3-b]indol-9-yl-2-pyridinyl)-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 158961551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).