7-naphthalen-1-yl-2-phenylbenzo[c]carbazole

C32H21N — CID 130351033

IUPAC7-naphthalen-1-yl-2-phenylbenzo[c]carbazole
SMILESc1ccc(-c2ccc3ccc4c(c3c2)c2ccccc2n4-c2cccc3ccccc23)cc1
InChIInChI=1S/C32H21N/c1-2-9-22(10-3-1)25-18-17-24-19-20-31-32(28(24)21-25)27-14-6-7-15-30(27)33(31)29-16-8-12-23-11-4-5-13-26(23)29/h1-21H
InChIKeyZKJMCMXKNIWECH-UHFFFAOYSA-N
MW419.53 g/mol
LogP8.76
Rot. Bonds2

About 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole

7-naphthalen-1-yl-2-phenylbenzo[c]carbazole (PubChem CID 130351033) has the molecular formula C32H21N and a molecular weight of 419.53 g/mol. Its IUPAC name is 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole.

Molecular Properties

Compound Name7-naphthalen-1-yl-2-phenylbenzo[c]carbazole
PubChem CID130351033
Molecular FormulaC32H21N
Molecular Weight419.53 g/mol
Exact Mass419.17
IUPAC Name7-naphthalen-1-yl-2-phenylbenzo[c]carbazole
SMILESc1ccc(-c2ccc3ccc4c(c3c2)c2ccccc2n4-c2cccc3ccccc23)cc1
InChIInChI=1S/C32H21N/c1-2-9-22(10-3-1)25-18-17-24-19-20-31-32(28(24)21-25)27-14-6-7-15-30(27)33(31)29-16-8-12-23-11-4-5-13-26(23)29/h1-21H
InChIKeyZKJMCMXKNIWECH-UHFFFAOYSA-N
XLogP8.76
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms33
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500419.53
LogP ≤ 58.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole?
The IUPAC name of 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole (CID 130351033) is 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole.
What is the SMILES notation for 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole?
The canonical SMILES for 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole is c1ccc(-c2ccc3ccc4c(c3c2)c2ccccc2n4-c2cccc3ccccc23)cc1.
What is the InChIKey of 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole?
The InChIKey is ZKJMCMXKNIWECH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H21N/c1-2-9-22(10-3-1)25-18-17-24-19-20-31-32(28(24)21-25)27-14-6-7-15-30(27)33(31)29-16-8-12-23-11-4-5-13-26(23)29/h1-21H.
What are the key properties of 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole?
7-naphthalen-1-yl-2-phenylbenzo[c]carbazole has a molecular weight of 419.53 g/mol, XLogP of 8.76, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-naphthalen-1-yl-2-phenylbenzo[c]carbazole is sourced from PubChem (CID 130351033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).