N-[(3S)-1-Methyl-2-Oxo-5-Phenyl-3H-1,4-Benzodiazepin-3-Yl]-1H-Indole-2-Carboxamide
[CAS# 103420-77-5]

Identification

• Name: N-[(3S)-1-Methyl-2-Oxo-5-Phenyl-3H-1,4-Benzodiazepin-3-Yl]-1H-Indole-2-Carboxamide
• Synonyms: N-[(3S)-2-Keto-1-Methyl-5-Phenyl-3H-1,4-Benzodiazepin-3-Yl]-1H-Indole-2-Carboxamide; D02693; Devazepide (Usan)
• Molecular Formula: C₂₅H₂₀N₄O₂
• Molecular Weight: 408.46
• CAS Registry Number: 103420-77-5
• SMILES: [C@@H]1(N=C(C2=C(N(C)C1=O)C=CC=C2)C3=CC=CC=C3)NC(C4=CC5=C([NH]4)C=CC=C5)=O
• InChI: 1S/C25H20N4O2/c1-29-21-14-8-6-12-18(21)22(16-9-3-2-4-10-16)27-23(25(29)31)28-24(30)20-15-17-11-5-7-13-19(17)26-20/h2-15,23,26H,1H3,(H,28,30)/t23-/m1/s1
• InChIKey: NFHRQQKPEBFUJK-HSZRJFAPSA-N

Properties

• Density: 1.314g/cm³ (Cal.)
• Boiling point: 758.623°C at 760 mmHg (Cal.)
• Flash point: 412.601°C (Cal.)
• solubility: Soluble to 100 mM in DMSO and to 50 mM in ethanol