3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole

C36H23N7 — CID 129294336

IUPAC3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4cc(-c5nc6ccccn6n5)cc(-c5nc6ccccn6n5)c4)ccc32)cc1
InChIInChI=1S/C36H23N7/c1-2-10-28(11-3-1)43-31-13-5-4-12-29(31)30-23-24(16-17-32(30)43)25-20-26(35-37-33-14-6-8-18-41(33)39-35)22-27(21-25)36-38-34-15-7-9-19-42(34)40-36/h1-23H
InChIKeyCPAWKOUCBPKWLW-UHFFFAOYSA-N
MW553.63 g/mol
LogP7.87
Rot. Bonds4

About 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole

3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole (PubChem CID 129294336) has the molecular formula C36H23N7 and a molecular weight of 553.63 g/mol. Its IUPAC name is 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole
PubChem CID129294336
Molecular FormulaC36H23N7
Molecular Weight553.63 g/mol
Exact Mass553.20
IUPAC Name3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole
SMILESc1ccc(-n2c3ccccc3c3cc(-c4cc(-c5nc6ccccn6n5)cc(-c5nc6ccccn6n5)c4)ccc32)cc1
InChIInChI=1S/C36H23N7/c1-2-10-28(11-3-1)43-31-13-5-4-12-29(31)30-23-24(16-17-32(30)43)25-20-26(35-37-33-14-6-8-18-41(33)39-35)22-27(21-25)36-38-34-15-7-9-19-42(34)40-36/h1-23H
InChIKeyCPAWKOUCBPKWLW-UHFFFAOYSA-N
XLogP7.87
TPSA65.31 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500553.63
LogP ≤ 57.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole with MolForge

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

Launch Full Analysis

Related Compounds

3-[3,5-bis(6-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole
CID 129285653
3,9-diphenyl-6-[3-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492191
3-[9-[3-[4,6-bis[3-(3,5-diphenylphenyl)phenyl]-1,3,5-triazin-2-yl]-5-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 134237073
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(3-phenylphenyl)carbazole;9-phenyl-3-[4-(9-phenylcarbazol-3-yl)phenyl]-6-(4-phenylphenyl)carbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 165019259
3,9-diphenyl-6-[3-[3-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole;3,9-diphenyl-6-[4-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 161263241
9-[4-(3,5-diphenylphenyl)phenyl]-3-phenyl-6-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
CID 118231210
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
3-[4-[6-[3,5-bis(9-phenylcarbazol-3-yl)phenyl]-2-phenylpyrimidin-4-yl]phenyl]-9-phenylcarbazole
CID 58527032
3-(2,6-diphenyl-4-pyridinyl)-9-phenylcarbazole
CID 70934573
9-phenyl-3-[5-(9-phenylcarbazol-3-yl)-3-pyridinyl]carbazole
CID 141339083
3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(3,5-diphenylphenyl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole
CID 161445204

Frequently Asked Questions

What is the IUPAC name of 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole?
The IUPAC name of 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole (CID 129294336) is 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole.
What is the SMILES notation for 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole?
The canonical SMILES for 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole is c1ccc(-n2c3ccccc3c3cc(-c4cc(-c5nc6ccccn6n5)cc(-c5nc6ccccn6n5)c4)ccc32)cc1.
What is the InChIKey of 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole?
The InChIKey is CPAWKOUCBPKWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H23N7/c1-2-10-28(11-3-1)43-31-13-5-4-12-29(31)30-23-24(16-17-32(30)43)25-20-26(35-37-33-14-6-8-18-41(33)39-35)22-27(21-25)36-38-34-15-7-9-19-42(34)40-36/h1-23H.
What are the key properties of 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole?
3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole has a molecular weight of 553.63 g/mol, XLogP of 7.87, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3,5-bis([1,2,4]triazolo[1,5-a]pyridin-2-yl)phenyl]-9-phenylcarbazole is sourced from PubChem (CID 129294336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).