5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole

C36H24N2 — CID 130232185

IUPAC5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole
SMILESc1ccc(-n2ccc3ccc(-c4ccc5c6cc7ccccc7cc6n(-c6ccccc6)c5c4)cc32)cc1
InChIInChI=1S/C36H24N2/c1-3-11-30(12-4-1)37-20-19-25-15-16-28(22-34(25)37)29-17-18-32-33-21-26-9-7-8-10-27(26)23-36(33)38(35(32)24-29)31-13-5-2-6-14-31/h1-24H
InChIKeyHNIPSKTZEJNBEJ-UHFFFAOYSA-N
MW484.60 g/mol
LogP9.55
Rot. Bonds3

About 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole

5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole (PubChem CID 130232185) has the molecular formula C36H24N2 and a molecular weight of 484.60 g/mol. Its IUPAC name is 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole.

Molecular Properties

Compound Name5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole
PubChem CID130232185
Molecular FormulaC36H24N2
Molecular Weight484.60 g/mol
Exact Mass484.19
IUPAC Name5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole
SMILESc1ccc(-n2ccc3ccc(-c4ccc5c6cc7ccccc7cc6n(-c6ccccc6)c5c4)cc32)cc1
InChIInChI=1S/C36H24N2/c1-3-11-30(12-4-1)37-20-19-25-15-16-28(22-34(25)37)29-17-18-32-33-21-26-9-7-8-10-27(26)23-36(33)38(35(32)24-29)31-13-5-2-6-14-31/h1-24H
InChIKeyHNIPSKTZEJNBEJ-UHFFFAOYSA-N
XLogP9.55
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.60
LogP ≤ 59.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole?
The IUPAC name of 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole (CID 130232185) is 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole.
What is the SMILES notation for 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole?
The canonical SMILES for 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole is c1ccc(-n2ccc3ccc(-c4ccc5c6cc7ccccc7cc6n(-c6ccccc6)c5c4)cc32)cc1.
What is the InChIKey of 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole?
The InChIKey is HNIPSKTZEJNBEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H24N2/c1-3-11-30(12-4-1)37-20-19-25-15-16-28(22-34(25)37)29-17-18-32-33-21-26-9-7-8-10-27(26)23-36(33)38(35(32)24-29)31-13-5-2-6-14-31/h1-24H.
What are the key properties of 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole?
5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole has a molecular weight of 484.60 g/mol, XLogP of 9.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-(1-phenylindol-6-yl)benzo[b]carbazole is sourced from PubChem (CID 130232185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).