Methyl (2S,5S)-2-[(2-Aminoacetyl)-Propylamino]-5-Formamido-7-Methylsulfanyl-4-Oxo-3-Phenyl-2-Propylheptanoate
[CAS# 136427-57-1]

Identification

• Name: Methyl (2S,5S)-2-[(2-Aminoacetyl)-Propylamino]-5-Formamido-7-Methylsulfanyl-4-Oxo-3-Phenyl-2-Propylheptanoate
• Synonyms: Methyl (2S,5S)-2-[(2-Aminoacetyl)-Propyl-Amino]-5-Formamido-7-Methylsulfanyl-4-Oxo-3-Phenyl-2-Propyl-Heptanoate; (2S,5S)-2-[(2-Amino-1-Oxoethyl)-Propylamino]-5-Formamido-7-(Methylthio)-4-Oxo-3-Phenyl-2-Propylheptanoic Acid Methyl Ester; (2S,5S)-5-Formamido-2-(Glycyl-Propyl-Amino)-4-Keto-7-(Methylthio)-3-Phenyl-2-Propyl-Enanthic Acid Methyl Ester
• Molecular Formula: C₂₄H₃₇N₃O₅S
• Molecular Weight: 479.63
• CAS Registry Number: 136427-57-1
• SMILES: [C@@](C(=O)OC)(N(C(CN)=O)CCC)(C(C1=CC=CC=C1)C([C@@H](NC=O)CCSC)=O)CCC
• InChI: 1S/C24H37N3O5S/c1-5-13-24(23(31)32-3,27(14-6-2)20(29)16-25)21(18-10-8-7-9-11-18)22(30)19(26-17-28)12-15-33-4/h7-11,17,19,21H,5-6,12-16,25H2,1-4H3,(H,26,28)/t19-,21?,24-/m0/s1
• InChIKey: GNAZCQZCHQUFCL-YZARGUDJSA-N

Properties

• Density: 1.152g/cm³ (Cal.)
• Boiling point: 684.036°C at 760 mmHg (Cal.)
• Flash point: 367.492°C (Cal.)