2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate

C20H12Cl2NO3- — CID 59060344

IUPAC2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate
SMILESO=C(Nc1ccc(-c2ccccc2)cc1C(=O)[O-])c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H13Cl2NO3/c21-14-7-8-15(17(22)11-14)19(24)23-18-9-6-13(10-16(18)20(25)26)12-4-2-1-3-5-12/h1-11H,(H,23,24)(H,25,26)/p-1
InChIKeyMHXSUKGJJRRCLH-UHFFFAOYSA-M
MW385.23 g/mol
LogP4.28
Rot. Bonds4

About 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate

2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate (PubChem CID 59060344) has the molecular formula C20H12Cl2NO3- and a molecular weight of 385.23 g/mol. Its IUPAC name is 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate.

Molecular Properties

Compound Name2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate
PubChem CID59060344
Molecular FormulaC20H12Cl2NO3-
Molecular Weight385.23 g/mol
Exact Mass384.02
IUPAC Name2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate
SMILESO=C(Nc1ccc(-c2ccccc2)cc1C(=O)[O-])c1ccc(Cl)cc1Cl
InChIInChI=1S/C20H13Cl2NO3/c21-14-7-8-15(17(22)11-14)19(24)23-18-9-6-13(10-16(18)20(25)26)12-4-2-1-3-5-12/h1-11H,(H,23,24)(H,25,26)/p-1
InChIKeyMHXSUKGJJRRCLH-UHFFFAOYSA-M
XLogP4.28
TPSA69.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.23
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,4-dichlorobenzoyl)amino]-5-(3-phenylphenyl)benzoic acid
CID 10183146
2-[(2,4-dichlorobenzoyl)amino]-5-(4-phenoxyphenyl)benzoic acid
CID 10227538
lithium;5-(1-benzothiophen-3-yl)-2-[(2,4-dichlorobenzoyl)amino]benzoate;methane
CID 161123218
2,4-dichloro-N-[4-chloro-2-(2-chlorobenzoyl)phenyl]benzamide
CID 4029873
2-[(2,4-dichlorobenzoyl)amino]-5-(furan-2-yl)benzoic acid
CID 10270857
2-[(4-chloro-2-hydroxybenzoyl)amino]-4-phenylbenzoic acid
CID 46853577
N-[2-(benzylcarbamoyl)-4-chlorophenyl]-2,4-dichlorobenzamide
CID 2192424
2-[(2,4-dichlorobenzoyl)amino]-5-(thiophen-3-ylmethoxy)benzoate
CID 59060393
2-[(2,4-dichlorobenzoyl)amino]-5-methylbenzoic acid
CID 4287647
2,4-dichloro-N-(1-methyl-3-phenylpyrazol-4-yl)benzamide
CID 138998439
lithium;2-[(2,4-dichlorobenzoyl)amino]-5-[2-(2-methoxyphenoxy)ethoxy]benzoate;molecular hydrogen
CID 159142897
2,4-dichloro-N-[2-[(4-phenylbenzoyl)amino]ethyl]benzamide
CID 108570885

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate?
The IUPAC name of 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate (CID 59060344) is 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate.
What is the SMILES notation for 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate?
The canonical SMILES for 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate is O=C(Nc1ccc(-c2ccccc2)cc1C(=O)[O-])c1ccc(Cl)cc1Cl.
What is the InChIKey of 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate?
The InChIKey is MHXSUKGJJRRCLH-UHFFFAOYSA-M. The full InChI is InChI=1S/C20H13Cl2NO3/c21-14-7-8-15(17(22)11-14)19(24)23-18-9-6-13(10-16(18)20(25)26)12-4-2-1-3-5-12/h1-11H,(H,23,24)(H,25,26)/p-1.
What are the key properties of 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate?
2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate has a molecular weight of 385.23 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dichlorobenzoyl)amino]-5-phenylbenzoate is sourced from PubChem (CID 59060344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).