9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole

C38H33N — CID 144920260

IUPAC9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole
SMILESCCC(C)c1ccc(-c2ccc(-c3ccc4c5c6c(ccc5n(-c5ccccc5)c4c3)CCC=C6)cc2)cc1
InChIInChI=1S/C38H33N/c1-3-26(2)27-13-15-28(16-14-27)29-17-19-30(20-18-29)32-21-23-35-37(25-32)39(33-10-5-4-6-11-33)36-24-22-31-9-7-8-12-34(31)38(35)36/h4-6,8,10-26H,3,7,9H2,1-2H3
InChIKeyYDNUFMUMCIURSG-UHFFFAOYSA-N
MW503.69 g/mol
LogP10.59
Rot. Bonds5

About 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole

9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole (PubChem CID 144920260) has the molecular formula C38H33N and a molecular weight of 503.69 g/mol. Its IUPAC name is 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole.

Molecular Properties

Compound Name9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole
PubChem CID144920260
Molecular FormulaC38H33N
Molecular Weight503.69 g/mol
Exact Mass503.26
IUPAC Name9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole
SMILESCCC(C)c1ccc(-c2ccc(-c3ccc4c5c6c(ccc5n(-c5ccccc5)c4c3)CCC=C6)cc2)cc1
InChIInChI=1S/C38H33N/c1-3-26(2)27-13-15-28(16-14-27)29-17-19-30(20-18-29)32-21-23-35-37(25-32)39(33-10-5-4-6-11-33)36-24-22-31-9-7-8-12-34(31)38(35)36/h4-6,8,10-26H,3,7,9H2,1-2H3
InChIKeyYDNUFMUMCIURSG-UHFFFAOYSA-N
XLogP10.59
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500503.69
LogP ≤ 510.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]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

N,7-diphenyl-N-[4-(4-phenylphenyl)phenyl]-3,4-dihydrobenzo[g]carbazol-9-amine
CID 145362267
21-phenyl-18-[4-[4-(1-phenylpropan-2-yl)phenyl]phenyl]-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1,3,7,11,13,15(20),16,18-octaene
CID 144919954
ethane;21-phenyl-18-[4-[4-(1-phenylpropan-2-yl)phenyl]phenyl]-21-azapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1,3,7,11,13,15(20),16,18-octaene
CID 144919953
4-[6-[4-(4-butan-2-ylphenyl)phenyl]-9-(4-propan-2-ylphenyl)carbazol-3-yl]-N,N-diphenylaniline;N-[4-[6-[4-(4-butan-2-ylphenyl)phenyl]-9-(4-propan-2-ylphenyl)carbazol-3-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 161492117
N-[4-[6-(4-butan-2-ylphenyl)-9-phenylcarbazol-3-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 154597309
3,9-diphenyl-6-(9-phenyl-7,8-dihydrocarbazol-3-yl)carbazole
CID 144650120
4-(4-butan-2-ylphenyl)-9-phenylcarbazole;methane
CID 162000855
4-(6-butan-2-yl-9-phenylcarbazol-3-yl)-N-phenyl-N-[4-(10-phenylanthracen-9-yl)phenyl]aniline
CID 59828050
3-[4-[7,8-dihydronaphthalen-2-yl-(4-phenylphenyl)methyl]phenyl]-9-phenylcarbazole
CID 146568610
N-[4-[4-[6-(4-butan-2-ylphenyl)-9-phenylcarbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 154597327
9-phenyl-2-(9-phenyl-7,8-dihydrocarbazol-2-yl)carbazole
CID 144650170
6-(7,9-diphenylcarbazol-3-yl)-2,9-diphenylcarbazole
CID 121262585

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole?
The IUPAC name of 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole (CID 144920260) is 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole.
What is the SMILES notation for 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole?
The canonical SMILES for 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole is CCC(C)c1ccc(-c2ccc(-c3ccc4c5c6c(ccc5n(-c5ccccc5)c4c3)CCC=C6)cc2)cc1.
What is the InChIKey of 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole?
The InChIKey is YDNUFMUMCIURSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H33N/c1-3-26(2)27-13-15-28(16-14-27)29-17-19-30(20-18-29)32-21-23-35-37(25-32)39(33-10-5-4-6-11-33)36-24-22-31-9-7-8-12-34(31)38(35)36/h4-6,8,10-26H,3,7,9H2,1-2H3.
What are the key properties of 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole?
9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole has a molecular weight of 503.69 g/mol, XLogP of 10.59, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(4-butan-2-ylphenyl)phenyl]-7-phenyl-3,4-dihydrobenzo[c]carbazole is sourced from PubChem (CID 144920260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).