9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide

C26H17BrCl2N2O — CID 174400340

IUPAC9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3ccc(Cl)cc3Cl)cc1n2Cc1ccccc1Br
InChIInChI=1S/C26H17BrCl2N2O/c27-21-6-2-1-4-16(21)14-31-23-7-3-5-20(26(30)32)25(23)19-10-8-15(12-24(19)31)18-11-9-17(28)13-22(18)29/h1-13H,14H2,(H2,30,32)
InChIKeyOBALHSSHACPPKO-UHFFFAOYSA-N
MW524.25 g/mol
LogP7.68
Rot. Bonds4

About 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide

9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide (PubChem CID 174400340) has the molecular formula C26H17BrCl2N2O and a molecular weight of 524.25 g/mol. Its IUPAC name is 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide.

Molecular Properties

Compound Name9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide
PubChem CID174400340
Molecular FormulaC26H17BrCl2N2O
Molecular Weight524.25 g/mol
Exact Mass521.99
IUPAC Name9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide
SMILESNC(=O)c1cccc2c1c1ccc(-c3ccc(Cl)cc3Cl)cc1n2Cc1ccccc1Br
InChIInChI=1S/C26H17BrCl2N2O/c27-21-6-2-1-4-16(21)14-31-23-7-3-5-20(26(30)32)25(23)19-10-8-15(12-24(19)31)18-11-9-17(28)13-22(18)29/h1-13H,14H2,(H2,30,32)
InChIKeyOBALHSSHACPPKO-UHFFFAOYSA-N
XLogP7.68
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.25
LogP ≤ 57.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-(2,4-dichlorophenyl)-9-[(2,3-dimethylphenyl)methyl]carbazole-4-carboxamide
CID 174417916
7-(2,4-dichlorophenyl)-9-[(2-ethoxyphenyl)methyl]carbazole-4-carboxamide
CID 174399730
7-(2,4-dichlorophenyl)-9-[[2-(difluoromethoxy)phenyl]methyl]carbazole-4-carboxamide
CID 175235599
7-(2,4-dichlorophenyl)-9-[(3-methylphenyl)methyl]carbazole-4-carboxamide
CID 175233520
9-[(2-bromophenyl)methyl]-7-(4-methoxyphenyl)carbazole-4-carboxamide
CID 174414385
7-(4-chlorophenyl)-9-[(2-phenylphenyl)methyl]carbazole-4-carboxamide
CID 175233517
7-(2,4-dichlorophenyl)-9-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]carbazole-4-carboxamide
CID 175235617
9-[(2-bromo-5-fluorophenyl)methyl]-7-(4-chlorophenyl)carbazole-4-carboxamide
CID 174414505
7-chloro-9-[(2-iodophenyl)methyl]carbazole-4-carboxamide
CID 174414775
9-[(4-bromo-2-fluorophenyl)methyl]-7-(4-chlorophenyl)carbazole-4-carboxamide
CID 174414567
7-(4-chlorophenyl)-9-[(2-methoxyphenyl)methyl]carbazole-4-carboxamide
CID 174417826
9-[(2-benzoylphenyl)methyl]-7-chlorocarbazole-4-carboxamide
CID 174414136

Frequently Asked Questions

What is the IUPAC name of 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide?
The IUPAC name of 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide (CID 174400340) is 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide.
What is the SMILES notation for 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide?
The canonical SMILES for 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide is NC(=O)c1cccc2c1c1ccc(-c3ccc(Cl)cc3Cl)cc1n2Cc1ccccc1Br.
What is the InChIKey of 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide?
The InChIKey is OBALHSSHACPPKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H17BrCl2N2O/c27-21-6-2-1-4-16(21)14-31-23-7-3-5-20(26(30)32)25(23)19-10-8-15(12-24(19)31)18-11-9-17(28)13-22(18)29/h1-13H,14H2,(H2,30,32).
What are the key properties of 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide?
9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide has a molecular weight of 524.25 g/mol, XLogP of 7.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2-bromophenyl)methyl]-7-(2,4-dichlorophenyl)carbazole-4-carboxamide is sourced from PubChem (CID 174400340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).