CAS 1229025-68-6

Phenylmethyl N-[(2S)-2-[(methoxycarbonyl)amino]propyl]carbamate

Description:

Phenylmethyl N-[(2S)-2-[(methoxycarbonyl)amino]propyl]carbamate, also known by its CAS number 1229025-68-6, is a chemical compound characterized by its carbamate functional group, which is derived from the reaction of phenylmethyl amine and a specific amino acid derivative. This compound features a phenylmethyl moiety, contributing to its aromatic properties, and a methoxycarbonyl group that enhances its solubility and reactivity. The presence of the chiral center at the 2-position of the propyl chain indicates that it can exist in enantiomeric forms, which may exhibit different biological activities. The compound is likely to be soluble in organic solvents due to its hydrophobic phenyl group, while the carbamate and methoxycarbonyl groups may impart some polar characteristics. Its potential applications could span pharmaceuticals, particularly in drug design, where the modulation of biological activity through structural variations is crucial. As with many carbamates, it may also exhibit specific interactions with biological targets, making it of interest in medicinal chemistry.

Formula: C₁₃H₁₈N₂O₄

InChI: InChI=1S/C13H18N2O4/c1-10(15-13(17)18-2)8-14-12(16)19-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,14,16)(H,15,17)/t10-/m0/s1

InChI key: InChIKey=FIKPNNGOJITHLO-JTQLQIEISA-N

SMILES: C(OC(NC[C@@H](NC(OC)=O)C)=O)C1=CC=CC=C1

Synonyms:

• Phenylmethyl N-[(2S)-2-[(methoxycarbonyl)amino]propyl]carbamate
• Carbamic acid, N-[(2S)-2-[(methoxycarbonyl)amino]propyl]-, phenylmethyl ester