chempirical

5-((Bis(benzyl)amino)acetyl)salicylamide

C23H22N2O3CAS 30566-92-8374.44 g/mol

Open in Covalent MOL file
H2NOONHO
KetonePhenolTertiary amine

Properties

Molecular formula
C23H22N2O3
Molar mass
374.44 g/mol
Exact mass
374.1630 Da
Melting point
179–180 °C
logP
4.16Crippen estimate
Polar surface area
84.6 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
8

Hazards

Not classified as hazardous under GHS by 2 ECHA notifiers. Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
30566-92-8
SMILES
N=C(O)c1cc(C(=O)CN(Cc2ccccc2)Cc2ccccc2)ccc1O
InChIKey
DNLPQXRWAKCKPX-UHFFFAOYSA-N
InChI
InChI=1S/C23H22N2O3/c24-23(28)20-13-19(11-12-21(20)26)22(27)16-25(14-17-7-3-1-4-8-17)15-18-9-5-2-6-10-18/h1-13,26H,14-16H2,(H2,24,28)

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Names and synonyms

5 names
  • 5-[2-[Bis(phenylmethyl)amino]acetyl]-2-hydroxybenzamide
  • Benzamide, 5-[2-[bis(phenylmethyl)amino]acetyl]-2-hydroxy-
  • Salicylamide, 5-(N,N-dibenzylglycyl)-
  • Benzamide, 5-[[bis(phenylmethyl)amino]acetyl]-2-hydroxy-
  • 5-(N,N-Dibenzylglycyl)salicylamide

Work with 5-((Bis(benzyl)amino)acetyl)salicylamide

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

5-(2-Bromoacetyl)-2-hydroxybenzamide73866-23-659 % similar Benzamide, 2-hydroxy-5-[2-[(1-methyl-3-phenylpropyl)amino]acetyl]-, hydrochloride (1:1)96441-14-455 % similar 5-Acetyl-2-hydroxybenzamide40187-51-751 % similar 2-[(1,1-Dimethylethyl)(phenylmethyl)amino]-1-[4-hydroxy-3-(hydroxymethyl)phenyl]ethanone64092-10-046 % similar n-Octanoyl-5-salicylic acid78418-01-641 % similar Salicylamide65-45-241 % similar 3-Hydroxy-2-naphthalenecarboxamide3665-51-841 % similar N-Benzylaminodiacetic acid3987-53-941 % similar

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

Same formula

N-(Triphenylmethyl)-L-asparagine132388-58-0

Elsewhere

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