4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide

C₁₅H₁₄ClNO₂CAS 41859-57-8275.73 g/mol

Open in Covalent MOL file

Amide Aryl halide Phenol

Properties

Molecular formula: C₁₅H₁₄ClNO₂
Molar mass: 275.73 g/mol
Exact mass: 275.0713 Da
logP: 3.02Crippen estimate
Polar surface area: 49.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 4

Identifiers

CAS number

41859-57-8

SMILES

O=C(NCCc1ccc(O)cc1)c1ccc(Cl)cc1

InChIKey

ZTLWJYCDAXUIBK-UHFFFAOYSA-N

InChI

InChI=1S/C15H14ClNO2/c16-13-5-3-12(4-6-13)15(19)17-10-9-11-1-7-14(18)8-2-11/h1-8,18H,9-10H2,(H,17,19)

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Names and synonyms

2 names

Benzamide, 4-chloro-N-[2-(4-hydroxyphenyl)ethyl]-
N-(4-Chlorobenzoyl)tyramine

Work with 4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Bezafibrate41859-67-057 % similar 4-Chloro-4′-hydroxybenzophenone42019-78-353 % similar Moclobemide71320-77-950 % similar 4-Hydroxybenzoic acid hydrazide5351-23-545 % similar 4-Chlorobenzoic acid hydrazide536-40-345 % similar 4-Chlorophenol106-48-944 % similar N-Methyltyramine370-98-940 % similar (4-Chlorophenyl)acetic acid1878-66-638 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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