2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole

C32H20N4 — CID 118429571

IUPAC2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole
SMILESc1ccc2c(c1)ccc1nn(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)nc12
InChIInChI=1S/C32H20N4/c1-2-10-22-21(9-1)17-18-27-32(22)34-36(33-27)31-20-19-30(25-11-3-4-14-26(25)31)35-28-15-7-5-12-23(28)24-13-6-8-16-29(24)35/h1-20H
InChIKeyIOFZJBHOEHDEPK-UHFFFAOYSA-N
MW460.54 g/mol
LogP7.82
Rot. Bonds2

About 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole

2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole (PubChem CID 118429571) has the molecular formula C32H20N4 and a molecular weight of 460.54 g/mol. Its IUPAC name is 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole.

Molecular Properties

Compound Name2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole
PubChem CID118429571
Molecular FormulaC32H20N4
Molecular Weight460.54 g/mol
Exact Mass460.17
IUPAC Name2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole
SMILESc1ccc2c(c1)ccc1nn(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)nc12
InChIInChI=1S/C32H20N4/c1-2-10-22-21(9-1)17-18-27-32(22)34-36(33-27)31-20-19-30(25-11-3-4-14-26(25)31)35-28-15-7-5-12-23(28)24-13-6-8-16-29(24)35/h1-20H
InChIKeyIOFZJBHOEHDEPK-UHFFFAOYSA-N
XLogP7.82
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.54
LogP ≤ 57.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole 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-[4-(benzotriazol-2-yl)naphthalen-1-yl]carbazole
CID 118429570
5-(4-benzo[e]benzotriazol-2-ylnaphthalen-1-yl)benzimidazolo[1,2-a]benzimidazole;10-(4-benzo[e]benzotriazol-2-ylnaphthalen-1-yl)-9-methylideneacridine;2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole;2-(4-indol-1-ylnaphthalen-1-yl)benzo[e]benzotriazole
CID 158346747
9-(4-carbazol-9-ylnaphthalen-1-yl)carbazole
CID 154791880
5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine
CID 118429493
5-carbazol-9-yl-2-phenylbenzo[e]benzotriazole
CID 118429562
10-(4-benzo[e]benzotriazol-2-ylphenyl)phenoxazine
CID 118429761
5-(4-benzo[e]benzotriazol-2-ylnaphthalen-1-yl)benzimidazolo[1,2-a]benzimidazole;10-(4-benzo[e]benzotriazol-2-ylnaphthalen-1-yl)-9-methylideneacridine;N-(4-benzo[e]benzotriazol-2-ylnaphthalen-1-yl)-4-methyl-N-(4-methylphenyl)naphthalen-1-amine;2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole;2-(4-indol-1-ylnaphthalen-1-yl)benzo[e]benzotriazole;methane
CID 162184227
4-[(4-benzo[e]benzotriazol-2-ylphenyl)diazenyl]aniline
CID 59476147
9-(6-carbazol-9-yl-2-phenylbenzotriazol-4-yl)carbazole
CID 164740337
9-[2,5,6-tri(carbazol-9-yl)-3-pyridinyl]carbazole
CID 122400298
5-[4-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)naphthalen-1-yl]benzo[b]carbazole
CID 134603586
9-naphthalen-1-yl-1-(9-naphthalen-1-ylcarbazol-1-yl)carbazole
CID 134507274

Frequently Asked Questions

What is the IUPAC name of 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole?
The IUPAC name of 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole (CID 118429571) is 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole.
What is the SMILES notation for 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole?
The canonical SMILES for 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole is c1ccc2c(c1)ccc1nn(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)nc12.
What is the InChIKey of 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole?
The InChIKey is IOFZJBHOEHDEPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20N4/c1-2-10-22-21(9-1)17-18-27-32(22)34-36(33-27)31-20-19-30(25-11-3-4-14-26(25)31)35-28-15-7-5-12-23(28)24-13-6-8-16-29(24)35/h1-20H.
What are the key properties of 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole?
2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole has a molecular weight of 460.54 g/mol, XLogP of 7.82, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-carbazol-9-ylnaphthalen-1-yl)benzo[e]benzotriazole is sourced from PubChem (CID 118429571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).