7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide

C32H23ClN2O — CID 175233517

IUPAC7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3ccc(Cl)cc3)cc1n2Cc1ccccc1-c1ccccc1
InChIInChI=1S/C32H23ClN2O/c33-25-16-13-21(14-17-25)23-15-18-27-30(19-23)35(29-12-6-11-28(31(27)29)32(34)36)20-24-9-4-5-10-26(24)22-7-2-1-3-8-22/h1-19H,20H2,(H2,34,36)
InChIKeyNHAZYYNHRCWKHB-UHFFFAOYSA-N
MW487.00 g/mol
LogP7.93
Rot. Bonds5

About 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide

7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide (PubChem CID 175233517) has the molecular formula C32H23ClN2O and a molecular weight of 487.00 g/mol. Its IUPAC name is 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide.

Molecular Properties

Compound Name7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide
PubChem CID175233517
Molecular FormulaC32H23ClN2O
Molecular Weight487.00 g/mol
Exact Mass486.15
IUPAC Name7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3ccc(Cl)cc3)cc1n2Cc1ccccc1-c1ccccc1
InChIInChI=1S/C32H23ClN2O/c33-25-16-13-21(14-17-25)23-15-18-27-30(19-23)35(29-12-6-11-28(31(27)29)32(34)36)20-24-9-4-5-10-26(24)22-7-2-1-3-8-22/h1-19H,20H2,(H2,34,36)
InChIKeyNHAZYYNHRCWKHB-UHFFFAOYSA-N
XLogP7.93
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.00
LogP ≤ 57.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide?
The IUPAC name of 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide (CID 175233517) is 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide.
What is the SMILES notation for 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide?
The canonical SMILES for 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide is NC(=O)c1cccc2c1c1ccc(-c3ccc(Cl)cc3)cc1n2Cc1ccccc1-c1ccccc1.
What is the InChIKey of 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide?
The InChIKey is NHAZYYNHRCWKHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23ClN2O/c33-25-16-13-21(14-17-25)23-15-18-27-30(19-23)35(29-12-6-11-28(31(27)29)32(34)36)20-24-9-4-5-10-26(24)22-7-2-1-3-8-22/h1-19H,20H2,(H2,34,36).
What are the key properties of 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide?
7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide has a molecular weight of 487.00 g/mol, XLogP of 7.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide is sourced from PubChem (CID 175233517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).