N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide

C15H12BrClN2O3 — CID 25470533

IUPACN-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cc(Br)ccc2O)cc1Cl
InChIInChI=1S/C15H12BrClN2O3/c1-8(20)18-13-4-3-10(7-12(13)17)19-15(22)11-6-9(16)2-5-14(11)21/h2-7,21H,1H3,(H,18,20)(H,19,22)
InChIKeyMZWOCNKTZNSAMA-UHFFFAOYSA-N
MW383.63 g/mol
LogP4.02
Rot. Bonds3

About N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide

N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide (PubChem CID 25470533) has the molecular formula C15H12BrClN2O3 and a molecular weight of 383.63 g/mol. Its IUPAC name is N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide
PubChem CID25470533
Molecular FormulaC15H12BrClN2O3
Molecular Weight383.63 g/mol
Exact Mass381.97
IUPAC NameN-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cc(Br)ccc2O)cc1Cl
InChIInChI=1S/C15H12BrClN2O3/c1-8(20)18-13-4-3-10(7-12(13)17)19-15(22)11-6-9(16)2-5-14(11)21/h2-7,21H,1H3,(H,18,20)(H,19,22)
InChIKeyMZWOCNKTZNSAMA-UHFFFAOYSA-N
XLogP4.02
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.63
LogP ≤ 54.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-4-chlorophenyl)-5-bromo-2-hydroxybenzamide
CID 107729182
5-bromo-N-(3,5-dichloro-4-fluorophenyl)-2-hydroxybenzamide
CID 107729876
N-(4-acetamido-3-chlorophenyl)-3-bromobenzamide
CID 51321405
N-(4-bromo-2-chlorophenyl)-2-hydroxy-5-iodobenzamide
CID 107731654
4-bromo-2-chloro-N-(3-chloro-4-hydroxyphenyl)benzamide
CID 63935703
N-(4-acetamido-3-chlorophenyl)-2-aminobenzamide
CID 43402960
5-bromo-N-(4-bromo-3-methylphenyl)-2-hydroxybenzamide
CID 103602071
5-bromo-N-(3-chloro-4-methylphenyl)-2-methylbenzamide
CID 65307918
5-[(4-bromo-2-chlorobenzoyl)amino]-2-hydroxybenzoic acid
CID 43805393
4-[(5-bromo-2-hydroxybenzoyl)amino]-2-methylbenzoic acid
CID 107729335
4-bromo-N-(4-bromo-2-chlorophenyl)-2-hydroxybenzamide
CID 63524501
5-bromo-N-(4-bromophenyl)-2-hydroxybenzamide;5-bromo-2-hydroxy-N-phenylbenzamide
CID 175557226

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide?
The IUPAC name of N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide (CID 25470533) is N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide.
What is the SMILES notation for N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide?
The canonical SMILES for N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide is CC(=O)Nc1ccc(NC(=O)c2cc(Br)ccc2O)cc1Cl.
What is the InChIKey of N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide?
The InChIKey is MZWOCNKTZNSAMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrClN2O3/c1-8(20)18-13-4-3-10(7-12(13)17)19-15(22)11-6-9(16)2-5-14(11)21/h2-7,21H,1H3,(H,18,20)(H,19,22).
What are the key properties of N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide?
N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide has a molecular weight of 383.63 g/mol, XLogP of 4.02, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide is sourced from PubChem (CID 25470533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).