9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole

C42H27N7 — CID 121241250

IUPAC9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole
SMILESc1cncc(-c2nc(-c3cccnc3)n(-c3cccc4c5ccccc5n(-c5cccc(-n6c7ccccc7c7ccccc76)c5)c34)n2)c1
InChIInChI=1S/C42H27N7/c1-4-19-36-32(15-1)33-16-2-5-20-37(33)47(36)30-13-7-14-31(25-30)48-38-21-6-3-17-34(38)35-18-8-22-39(40(35)48)49-42(29-12-10-24-44-27-29)45-41(46-49)28-11-9-23-43-26-28/h1-27H
InChIKeyUGBVVSZLBPPRHL-UHFFFAOYSA-N
MW629.73 g/mol
LogP9.59
Rot. Bonds5

About 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole

9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole (PubChem CID 121241250) has the molecular formula C42H27N7 and a molecular weight of 629.73 g/mol. Its IUPAC name is 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole.

Molecular Properties

Compound Name9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole
PubChem CID121241250
Molecular FormulaC42H27N7
Molecular Weight629.73 g/mol
Exact Mass629.23
IUPAC Name9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole
SMILESc1cncc(-c2nc(-c3cccnc3)n(-c3cccc4c5ccccc5n(-c5cccc(-n6c7ccccc7c7ccccc76)c5)c34)n2)c1
InChIInChI=1S/C42H27N7/c1-4-19-36-32(15-1)33-16-2-5-20-37(33)47(36)30-13-7-14-31(25-30)48-38-21-6-3-17-34(38)35-18-8-22-39(40(35)48)49-42(29-12-10-24-44-27-29)45-41(46-49)28-11-9-23-43-26-28/h1-27H
InChIKeyUGBVVSZLBPPRHL-UHFFFAOYSA-N
XLogP9.59
TPSA66.35 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500629.73
LogP ≤ 59.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole 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

9-(3-carbazol-9-ylphenyl)-3-(2,5-diphenyl-1,2,4-triazol-3-yl)carbazole
CID 121241285
9-(3-carbazol-9-ylphenyl)-2-(3,5-diphenyltriazol-4-yl)carbazole;9-(3-carbazol-9-ylphenyl)-2-(1,5-dipyridin-3-yl-1,2,4-triazol-3-yl)carbazole;9-(3-carbazol-9-ylphenyl)-2-(2,5-dipyridin-3-yl-1,2,4-triazol-3-yl)carbazole;9-(3-carbazol-9-ylphenyl)-2-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole;methane
CID 158448768
9-(3-carbazol-9-ylphenyl)-1-(1,5-dipyridin-3-yltriazol-4-yl)carbazole;9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yltriazol-4-yl)carbazole;9-(3-carbazol-9-ylphenyl)-1-(4,5-dipyridin-3-yltriazol-1-yl)carbazole;9-(3-carbazol-9-ylphenyl)-1-(4,5-dipyridin-3-yl-1,2,4-triazol-3-yl)carbazole
CID 159166576
9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yltriazol-4-yl)carbazole
CID 121241279
1-carbazol-9-yl-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 121459383
3-carbazol-9-yl-9-(3-pyridin-3-ylphenyl)carbazole
CID 126749641
9-[3-[3-(3,5-diphenyl-1,2,4-triazol-1-yl)carbazol-9-yl]phenyl]pyrido[2,3-b]indole;9-[3-[3-(3,5-diphenyl-1,2,4-triazol-1-yl)carbazol-9-yl]phenyl]pyrido[3,4-b]indole;8-[3-[3-(3,5-diphenyl-1,2,4-triazol-1-yl)carbazol-9-yl]phenyl]-5,8,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;8-[3-[3-(3,5-diphenyl-1,2,4-triazol-1-yl)carbazol-9-yl]phenyl]-6,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158452701
9-[3-carbazol-9-yl-5-(4,6-dipyridin-3-ylpyrimidin-2-yl)phenyl]carbazole
CID 162774177
9-(2-pyridin-3-yl-4-pyridinyl)carbazole
CID 171768043
4-(3-pyridin-3-ylphenyl)-1,4-diazaheptacyclo[14.12.0.02,14.03,11.05,10.017,22.023,28]octacosa-2(14),3(11),5,7,9,12,15,17,19,21,23,25,27-tridecaene
CID 118330984
9-(2,6-dipyridin-3-yl-4-pyridinyl)carbazole
CID 135264911
12-[3-[2-(3,5-diphenyl-1,2,4-triazol-1-yl)carbazol-9-yl]phenyl]-[1]benzofuro[2,3-a]carbazole
CID 146226741

Frequently Asked Questions

What is the IUPAC name of 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole?
The IUPAC name of 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole (CID 121241250) is 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole.
What is the SMILES notation for 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole?
The canonical SMILES for 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole is c1cncc(-c2nc(-c3cccnc3)n(-c3cccc4c5ccccc5n(-c5cccc(-n6c7ccccc7c7ccccc76)c5)c34)n2)c1.
What is the InChIKey of 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole?
The InChIKey is UGBVVSZLBPPRHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H27N7/c1-4-19-36-32(15-1)33-16-2-5-20-37(33)47(36)30-13-7-14-31(25-30)48-38-21-6-3-17-34(38)35-18-8-22-39(40(35)48)49-42(29-12-10-24-44-27-29)45-41(46-49)28-11-9-23-43-26-28/h1-27H.
What are the key properties of 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole?
9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole has a molecular weight of 629.73 g/mol, XLogP of 9.59, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-carbazol-9-ylphenyl)-1-(3,5-dipyridin-3-yl-1,2,4-triazol-1-yl)carbazole is sourced from PubChem (CID 121241250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).