2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid

C20H14ClNO4 — CID 46853577

IUPAC2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid
SMILESO=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1ccc(Cl)cc1O
InChIInChI=1S/C20H14ClNO4/c21-14-7-9-16(18(23)11-14)19(24)22-17-10-13(6-8-15(17)20(25)26)12-4-2-1-3-5-12/h1-11,23H,(H,22,24)(H,25,26)
InChIKeyRENMYCUJXYANBN-UHFFFAOYSA-N
MW367.79 g/mol
LogP4.66
Rot. Bonds4

About 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid

2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid (PubChem CID 46853577) has the molecular formula C20H14ClNO4 and a molecular weight of 367.79 g/mol. Its IUPAC name is 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid.

Molecular Properties

Compound Name2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid
PubChem CID46853577
Molecular FormulaC20H14ClNO4
Molecular Weight367.79 g/mol
Exact Mass367.06
IUPAC Name2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid
SMILESO=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1ccc(Cl)cc1O
InChIInChI=1S/C20H14ClNO4/c21-14-7-9-16(18(23)11-14)19(24)22-17-10-13(6-8-15(17)20(25)26)12-4-2-1-3-5-12/h1-11,23H,(H,22,24)(H,25,26)
InChIKeyRENMYCUJXYANBN-UHFFFAOYSA-N
XLogP4.66
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.79
LogP ≤ 54.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-carboxybenzoyl)amino]-4-phenylbenzoic acid
CID 167346908
2-[(2-hydroxy-4-pyrimidin-2-ylbenzoyl)amino]-4-phenylbenzoic acid
CID 66990128
2-[(4-chloro-2-hydroxybenzoyl)amino]-5-hydroxybenzoic acid
CID 61405727
2-[(2,4-difluorobenzoyl)amino]-4-phenylbenzoic acid
CID 67343264
2-[(2,4-dichlorobenzoyl)amino]-5-(3-phenylphenyl)benzoic acid
CID 10183146
2-benzamido-4-(3-chloro-4-fluorophenyl)benzoic acid
CID 67341971
2-[(2-hydroxy-5-phenoxybenzoyl)amino]-4-phenylbenzoic acid
CID 58508485
2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-4-phenylbenzoic acid
CID 67342565
2-[(6-chloropyridine-3-carbonyl)amino]-4-phenylbenzoic acid
CID 87408033
2-benzamido-4-(3,4-difluorophenyl)benzoic acid
CID 67342195
2-[(2-hydroxy-3-methoxybenzoyl)amino]-4-phenylbenzoic acid
CID 46853580
4-chloro-2-[(2-chloro-5-hydroxybenzoyl)amino]benzoic acid
CID 106500157

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid?
The IUPAC name of 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid (CID 46853577) is 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid.
What is the SMILES notation for 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid?
The canonical SMILES for 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid is O=C(Nc1cc(-c2ccccc2)ccc1C(=O)O)c1ccc(Cl)cc1O.
What is the InChIKey of 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid?
The InChIKey is RENMYCUJXYANBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14ClNO4/c21-14-7-9-16(18(23)11-14)19(24)22-17-10-13(6-8-15(17)20(25)26)12-4-2-1-3-5-12/h1-11,23H,(H,22,24)(H,25,26).
What are the key properties of 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid?
2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid has a molecular weight of 367.79 g/mol, XLogP of 4.66, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid is sourced from PubChem (CID 46853577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).