Terlakiren
[CAS# 119625-78-4]

Identification

• Name: Terlakiren
• Synonyms: Isopropyl (2R,3S)-4-Cyclohexyl-2-Hydroxy-3-[[(2R)-3-Methylsulfanyl-2-[[(2S)-2-(Morpholine-4-Carbonylamino)-3-Phenyl-Propanoyl]Amino]Propanoyl]Amino]Butanoate; (2R,3S)-4-Cyclohexyl-2-Hydroxy-3-[[(2R)-3-(Methylthio)-2-[[(2S)-2-[(Morpholino-Oxomethyl)Amino]-1-Oxo-3-Phenylpropyl]Amino]-1-Oxopropyl]Amino]Butanoic Acid Isopropyl Ester; (2R,3S)-4-Cyclohexyl-2-Hydroxy-3-[[(2R)-3-(Methylthio)-2-[[(2S)-2-(Morpholine-4-Carbonylamino)-3-Phenyl-Propanoyl]Amino]Propanoyl]Amino]Butyric Acid Isopropyl Ester
• Molecular Formula: C₃₁H₄₈N₄O₇S
• Molecular Weight: 620.80
• CAS Registry Number: 119625-78-4
• SMILES: [C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)N1CCOCC1)CC2=CC=CC=C2)CSC)([C@@H](O)C(OC(C)C)=O)CC3CCCCC3
• InChI: 1S/C31H48N4O7S/c1-21(2)42-30(39)27(36)24(18-22-10-6-4-7-11-22)32-29(38)26(20-43-3)33-28(37)25(19-23-12-8-5-9-13-23)34-31(40)35-14-16-41-17-15-35/h5,8-9,12-13,21-22,24-27,36H,4,6-7,10-11,14-20H2,1-3H3,(H,32,38)(H,33,37)(H,34,40)/t24-,25-,26-,27+/m0/s1
• InChIKey: UZQBKCWYZBHBOW-YIPNQBBMSA-N

Properties

• Density: 1.205g/cm³ (Cal.)
• Boiling point: 908.263°C at 760 mmHg (Cal.)
• Flash point: 503.1°C (Cal.)