N-[(4-Phenyl-2,3,4,5-tetrahydro-1H-pyrido[2,3-b][1,4]diazepin-2-yl)methyl]acetamide
[CAS# 87474-35-9]

Identification

• Name: N-[(4-Phenyl-2,3,4,5-tetrahydro-1H-pyrido[2,3-b][1,4]diazepin-2-yl)methyl]acetamide
• Synonyms: 2-Acetaminomethylene-4-phenyl-1H-tetrahydro-6-azabenzo-1,5-diazepine; Acetamide, N-((2,3,4,5-tetrahydro-4-phenyl-1H-pyrido(2,3-b)(1,4)diazepin-2-yl)methyl)-
• Molecular Formula: C₁₇H₂₀N₄O
• Molecular Weight: 296.37
• CAS Registry Number: 87474-35-9
• SMILES: O=C(NCC3Nc1c(nccc1)NC(c2ccccc2)C3)C
• InChI: 1S/C17H20N4O/c1-12(22)19-11-14-10-16(13-6-3-2-4-7-13)21-17-15(20-14)8-5-9-18-17/h2-9,14,16,20H,10-11H2,1H3,(H,18,21)(H,19,22)
• InChIKey: OEJCSNLWCXRCTJ-UHFFFAOYSA-N

Properties

• Density: 1.125g/cm³ (Cal.)
• Boiling point: 584.623°C at 760 mmHg (Cal.)
• Flash point: 307.369°C (Cal.)