3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole

C34H29N — CID 158357901

IUPAC3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole
SMILESCC(C)c1ccc2c(c1)c1cc(-c3ccc(Cc4ccccc4)cc3)ccc1n2-c1ccccc1
InChIInChI=1S/C34H29N/c1-24(2)28-17-19-33-31(22-28)32-23-29(18-20-34(32)35(33)30-11-7-4-8-12-30)27-15-13-26(14-16-27)21-25-9-5-3-6-10-25/h3-20,22-24H,21H2,1-2H3
InChIKeyBQJFKMQIFOVBDB-UHFFFAOYSA-N
MW451.61 g/mol
LogP9.16
Rot. Bonds5

About 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole

3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole (PubChem CID 158357901) has the molecular formula C34H29N and a molecular weight of 451.61 g/mol. Its IUPAC name is 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole.

Molecular Properties

Compound Name3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole
PubChem CID158357901
Molecular FormulaC34H29N
Molecular Weight451.61 g/mol
Exact Mass451.23
IUPAC Name3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole
SMILESCC(C)c1ccc2c(c1)c1cc(-c3ccc(Cc4ccccc4)cc3)ccc1n2-c1ccccc1
InChIInChI=1S/C34H29N/c1-24(2)28-17-19-33-31(22-28)32-23-29(18-20-34(32)35(33)30-11-7-4-8-12-30)27-15-13-26(14-16-27)21-25-9-5-3-6-10-25/h3-20,22-24H,21H2,1-2H3
InChIKeyBQJFKMQIFOVBDB-UHFFFAOYSA-N
XLogP9.16
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500451.61
LogP ≤ 59.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

9-phenyl-3-[4-[[4-(4-phenylphenyl)phenyl]methyl]phenyl]carbazole
CID 157272513
9-(4-phenylphenyl)-3-[4-[4-[(4-phenylphenyl)methyl]phenyl]phenyl]carbazole
CID 158819686
3-phenyl-9-[4-[6-[9-phenyl-6-[4-(4-propan-2-ylphenyl)phenyl]carbazol-3-yl]naphthalen-2-yl]phenyl]-6-[4-(4-propan-2-ylphenyl)phenyl]carbazole
CID 139504733
9-phenyl-3-[4-[[4-(2-phenylphenyl)phenyl]methyl]phenyl]carbazole
CID 157272511
3-benzyl-6-(3-methylphenyl)-9-phenylcarbazole
CID 146531656
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-3-(4-phenylphenyl)-6-[4-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 158399670
3-[4-[bis(4-phenylphenyl)methyl]phenyl]-9-phenylcarbazole
CID 139542507
9-(4-propan-2-ylphenyl)-3-[3-[9-[9-(4-propan-2-ylphenyl)carbazol-3-yl]carbazol-3-yl]carbazol-9-yl]carbazole
CID 71232684
9-phenyl-3-(3-phenylphenyl)-6-[4-[9-phenyl-6-(3-phenylphenyl)carbazol-3-yl]phenyl]carbazole
CID 129054646
3-(4-methylphenyl)-6,9-diphenylcarbazole
CID 90290564
3-(4-carbazol-9-ylphenyl)-9-phenylcarbazole
CID 20685483
3-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 90085403

Frequently Asked Questions

What is the IUPAC name of 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole?
The IUPAC name of 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole (CID 158357901) is 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole.
What is the SMILES notation for 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole?
The canonical SMILES for 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole is CC(C)c1ccc2c(c1)c1cc(-c3ccc(Cc4ccccc4)cc3)ccc1n2-c1ccccc1.
What is the InChIKey of 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole?
The InChIKey is BQJFKMQIFOVBDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H29N/c1-24(2)28-17-19-33-31(22-28)32-23-29(18-20-34(32)35(33)30-11-7-4-8-12-30)27-15-13-26(14-16-27)21-25-9-5-3-6-10-25/h3-20,22-24H,21H2,1-2H3.
What are the key properties of 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole?
3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole has a molecular weight of 451.61 g/mol, XLogP of 9.16, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-benzylphenyl)-9-phenyl-6-propan-2-ylcarbazole is sourced from PubChem (CID 158357901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).