3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole

C37H27N — CID 67964803

IUPAC3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole
SMILESCc1ccc(-c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C37H27N/c1-26-17-19-27(20-18-26)28-9-7-10-29(23-28)30-11-8-12-31(24-30)32-21-22-37-35(25-32)34-15-5-6-16-36(34)38(37)33-13-3-2-4-14-33/h2-25H,1H3
InChIKeyAYFAOUSXPTWKNI-UHFFFAOYSA-N
MW485.63 g/mol
LogP10.09
Rot. Bonds4

About 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole

3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole (PubChem CID 67964803) has the molecular formula C37H27N and a molecular weight of 485.63 g/mol. Its IUPAC name is 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole.

Molecular Properties

Compound Name3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole
PubChem CID67964803
Molecular FormulaC37H27N
Molecular Weight485.63 g/mol
Exact Mass485.21
IUPAC Name3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole
SMILESCc1ccc(-c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c2)cc1
InChIInChI=1S/C37H27N/c1-26-17-19-27(20-18-26)28-9-7-10-29(23-28)30-11-8-12-31(24-30)32-21-22-37-35(25-32)34-15-5-6-16-36(34)38(37)33-13-3-2-4-14-33/h2-25H,1H3
InChIKeyAYFAOUSXPTWKNI-UHFFFAOYSA-N
XLogP10.09
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.63
LogP ≤ 510.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-[3-[3-(4-methylphenyl)phenyl]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-(4-methylphenyl)phenyl]-9-(3-phenylphenyl)carbazole
CID 144639934
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
3-[9-[4-[3-(3-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4-[3-(4-methylphenyl)phenyl]phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 160753219
3-[4-[9-[4-(4-methylphenyl)phenyl]carbazol-3-yl]phenyl]-9-phenylcarbazole
CID 121287007
3-(9-phenylcarbazol-3-yl)-9-[4-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590601
3-(3-methyl-5-phenylphenyl)-9-phenylcarbazole
CID 123628919
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[4-[4-[4-[3-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590322
3,9-diphenyl-6-[3-(9-phenylcarbazol-3-yl)-5-(4-phenylphenyl)phenyl]carbazole
CID 122492191
3-(4-methylphenyl)-6,9-diphenylcarbazole
CID 90290564
3-[9-[4-(3-methyl-5-phenylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole;3-methyl-9-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazole
CID 157292241
3-[9-(4-phenylphenyl)carbazol-3-yl]-9-[3-[3-[4-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 154590474

Frequently Asked Questions

What is the IUPAC name of 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole?
The IUPAC name of 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole (CID 67964803) is 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole.
What is the SMILES notation for 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole?
The canonical SMILES for 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole is Cc1ccc(-c2cccc(-c3cccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c3)c2)cc1.
What is the InChIKey of 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole?
The InChIKey is AYFAOUSXPTWKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H27N/c1-26-17-19-27(20-18-26)28-9-7-10-29(23-28)30-11-8-12-31(24-30)32-21-22-37-35(25-32)34-15-5-6-16-36(34)38(37)33-13-3-2-4-14-33/h2-25H,1H3.
What are the key properties of 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole?
3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole has a molecular weight of 485.63 g/mol, XLogP of 10.09, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[3-(4-methylphenyl)phenyl]phenyl]-9-phenylcarbazole is sourced from PubChem (CID 67964803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).