2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid

C14H9Cl2NO3 — CID 3883439

IUPAC2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid
SMILESO=C(O)c1ccccc1C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H9Cl2NO3/c15-8-5-6-12(11(16)7-8)17-13(18)9-3-1-2-4-10(9)14(19)20/h1-7H,(H,17,18)(H,19,20)
InChIKeyJZMNZEQUBPENTL-UHFFFAOYSA-N
MW310.14 g/mol
LogP3.94
Rot. Bonds3

About 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid

2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid (PubChem CID 3883439) has the molecular formula C14H9Cl2NO3 and a molecular weight of 310.14 g/mol. Its IUPAC name is 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid.

Molecular Properties

Compound Name2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid
PubChem CID3883439
Molecular FormulaC14H9Cl2NO3
Molecular Weight310.14 g/mol
Exact Mass309.00
IUPAC Name2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid
SMILESO=C(O)c1ccccc1C(=O)Nc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H9Cl2NO3/c15-8-5-6-12(11(16)7-8)17-13(18)9-3-1-2-4-10(9)14(19)20/h1-7H,(H,17,18)(H,19,20)
InChIKeyJZMNZEQUBPENTL-UHFFFAOYSA-N
XLogP3.94
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.14
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,4-dichlorophenyl)-2-[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]benzamide
CID 5150334
N-(2,4-dichlorophenyl)-2-[[2-[(2,4-dichlorophenyl)carbamoyl]phenyl]disulfanyl]benzamide
CID 6483556
2-[[4-[2-(2,4-dichloroanilino)-2-oxoethyl]sulfanylphenyl]carbamoyl]benzoic acid
CID 22785275
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
2-[[(2,4-dichlorobenzoyl)amino]carbamoyl]benzoic acid
CID 1010177
2-(benzenesulfonamido)-N-(2,4-dichlorophenyl)benzamide
CID 155547933
N-(2,4-dichlorophenyl)-2-[ethyl(methyl)amino]benzamide
CID 155514070
2-[[4-[2-(2,4-dichloroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]carbamoyl]benzoic acid
CID 22785345
N-(2,4-dichlorophenyl)-2-propan-2-ylsulfanylbenzamide
CID 17224609
N-(2,4-dichlorophenyl)-2-(2-phenoxyethoxy)benzamide
CID 4954259
5-amino-2-[(2-chlorobenzoyl)amino]benzoic acid
CID 63115639
2-bromo-N-(2,4-dichlorophenyl)pyridine-3-carboxamide
CID 113255485

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid?
The IUPAC name of 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid (CID 3883439) is 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid.
What is the SMILES notation for 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid?
The canonical SMILES for 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid is O=C(O)c1ccccc1C(=O)Nc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid?
The InChIKey is JZMNZEQUBPENTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2NO3/c15-8-5-6-12(11(16)7-8)17-13(18)9-3-1-2-4-10(9)14(19)20/h1-7H,(H,17,18)(H,19,20).
What are the key properties of 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid?
2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid has a molecular weight of 310.14 g/mol, XLogP of 3.94, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dichlorophenyl)carbamoyl]benzoic acid is sourced from PubChem (CID 3883439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).