1.0 2026-09-21 16:40:11 UTC 2026-09-21 16:40:11 UTC FDB116748 Asperphenamate [(2S)-2-benzamido-3-phenyl-propyl] (2S)-2-benzamido-3-phenyl-propanoate [(2S)-2-benzamido-3-phenylpropyl] (2S)-2-benzamido-3-phenylpropanoate C32H30N2O4 506.602 506.220557454 N-[(2S)-1-{[(2S)-2-{[hydroxy(phenyl)methylidene]amino}-3-phenylpropanoyl]oxy}-3-phenylpropan-2-yl]benzenecarboximidic acid N-[(2S)-1-{[(2S)-2-{[hydroxy(phenyl)methylidene]amino}-3-phenylpropanoyl]oxy}-3-phenylpropan-2-yl]benzenecarboximidic acid [H][C@@](COC(=O)[C@]([H])(CC1=CC=CC=C1)N=C(O)C1=CC=CC=C1)(CC1=CC=CC=C1)N=C(O)C1=CC=CC=C1 InChI=1S/C32H30N2O4/c35-30(26-17-9-3-10-18-26)33-28(21-24-13-5-1-6-14-24)23-38-32(37)29(22-25-15-7-2-8-16-25)34-31(36)27-19-11-4-12-20-27/h1-20,28-29H,21-23H2,(H,33,35)(H,34,36)/t28-,29-/m0/s1 CVULDJMCSSACEO-VMPREFPWSA-N belongs to the class of organic compounds known as phenylalanine and derivatives. Phenylalanine and derivatives are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Phenylalanine and derivatives Organic compounds Organic acids and derivatives Carboxylic acids and derivatives Amino acids, peptides, and analogues Aromatic homomonocyclic compounds Alpha amino acid esters Amphetamines and derivatives Benzoyl derivatives Carbonyl compounds Carboxylic acid esters Fatty acid esters Hippuric acids and derivatives Hydrocarbon derivatives Monocarboxylic acids and derivatives N-acyl-alpha amino acids and derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Secondary carboxylic acid amides Alpha-amino acid ester Amphetamine or derivatives Aromatic homomonocyclic compound Benzamide Benzenoid Benzoic acid or derivatives Benzoyl Carbonyl group Carboxamide group Carboxylic acid ester Fatty acid ester Fatty acyl Hippuric acid or derivatives Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety N-acyl-alpha amino acid or derivatives Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenylalanine or derivatives Secondary carboxylic acid amide logp 5.28 ALOGPS logs -6.14 ALOGPS solubility 3.71e-04 g/l ALOGPS logp 7.48 ChemAxon pka_strongest_acidic 7.96 ChemAxon pka_strongest_basic 3.68 ChemAxon iupac N-[(2S)-1-{[(2S)-2-{[hydroxy(phenyl)methylidene]amino}-3-phenylpropanoyl]oxy}-3-phenylpropan-2-yl]benzenecarboximidic acid ChemAxon average_mass 506.602 ChemAxon mono_mass 506.220557454 ChemAxon smiles [H][C@@](COC(=O)[C@]([H])(CC1=CC=CC=C1)N=C(O)C1=CC=CC=C1)(CC1=CC=CC=C1)N=C(O)C1=CC=CC=C1 ChemAxon formula C32H30N2O4 ChemAxon inchi InChI=1S/C32H30N2O4/c35-30(26-17-9-3-10-18-26)33-28(21-24-13-5-1-6-14-24)23-38-32(37)29(22-25-15-7-2-8-16-25)34-31(36)27-19-11-4-12-20-27/h1-20,28-29H,21-23H2,(H,33,35)(H,34,36)/t28-,29-/m0/s1 ChemAxon inchikey CVULDJMCSSACEO-VMPREFPWSA-N ChemAxon polar_surface_area 91.48 ChemAxon refractivity 148.14 ChemAxon polarizability 55.36 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge 2 ChemAxon formal_charge 0 ChemAxon