4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide

C14H11BrClNO2 — CID 103830447

IUPAC4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide
SMILESCc1ccc(NC(=O)c2ccc(Br)c(O)c2)cc1Cl
InChIInChI=1S/C14H11BrClNO2/c1-8-2-4-10(7-12(8)16)17-14(19)9-3-5-11(15)13(18)6-9/h2-7,18H,1H3,(H,17,19)
InChIKeyHNYLQFOKPDOJBG-UHFFFAOYSA-N
MW340.60 g/mol
LogP4.37
Rot. Bonds2

About 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide

4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide (PubChem CID 103830447) has the molecular formula C14H11BrClNO2 and a molecular weight of 340.60 g/mol. Its IUPAC name is 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide.

Molecular Properties

Compound Name4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide
PubChem CID103830447
Molecular FormulaC14H11BrClNO2
Molecular Weight340.60 g/mol
Exact Mass338.97
IUPAC Name4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide
SMILESCc1ccc(NC(=O)c2ccc(Br)c(O)c2)cc1Cl
InChIInChI=1S/C14H11BrClNO2/c1-8-2-4-10(7-12(8)16)17-14(19)9-3-5-11(15)13(18)6-9/h2-7,18H,1H3,(H,17,19)
InChIKeyHNYLQFOKPDOJBG-UHFFFAOYSA-N
XLogP4.37
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.60
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-3-chloro-N-(3-chloro-4-methylphenyl)benzamide
CID 81307032
3-bromo-N-(3-chloro-4-methylphenyl)-4-methylbenzamide
CID 952306
N-(4-bromo-3-methylphenyl)-3-chloro-4-methylbenzamide
CID 2296154
N-(3-chloro-4-methylphenyl)-4-hydroxy-3-methylbenzamide
CID 103951695
4-bromo-N-(3-chloro-4-methylphenyl)-3-nitrobenzamide
CID 26087185
N-(3-chloro-4-methylphenyl)-4-methylbenzamide
CID 710602
4-[(3-chloro-4-methylbenzoyl)amino]-2-hydroxybenzoic acid
CID 28669002
3-bromo-N-(3-bromo-4-methylphenyl)-4-methylbenzamide
CID 81471558
6-bromo-N-(3-chloro-4-methylphenyl)pyridine-3-carboxamide
CID 66462281
4-bromo-N-(3-bromo-4-fluorophenyl)-3-hydroxybenzamide
CID 113342873
4-[(3-chloro-4-methylbenzoyl)amino]benzoic acid
CID 28914625
N-(3-acetamidophenyl)-4-bromo-3-hydroxybenzamide
CID 103871323

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide?
The IUPAC name of 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide (CID 103830447) is 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide.
What is the SMILES notation for 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide?
The canonical SMILES for 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide is Cc1ccc(NC(=O)c2ccc(Br)c(O)c2)cc1Cl.
What is the InChIKey of 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide?
The InChIKey is HNYLQFOKPDOJBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO2/c1-8-2-4-10(7-12(8)16)17-14(19)9-3-5-11(15)13(18)6-9/h2-7,18H,1H3,(H,17,19).
What are the key properties of 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide?
4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide has a molecular weight of 340.60 g/mol, XLogP of 4.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(3-chloro-4-methylphenyl)-3-hydroxybenzamide is sourced from PubChem (CID 103830447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).