(4R,5S,6S,7R)-1,3-Bis[(2-Fluorophenyl)Methyl]-5,6-Dihydroxy-4,7-Bis(Phenylmethyl)-1,3-Diazepan-2-One
[CAS# 153182-43-5]

Identification

• Name: (4R,5S,6S,7R)-1,3-Bis[(2-Fluorophenyl)Methyl]-5,6-Dihydroxy-4,7-Bis(Phenylmethyl)-1,3-Diazepan-2-One
• Synonyms: (4R,5S,6S,7R)-4,7-Bis(Benzyl)-1,3-Bis(2-Fluorobenzyl)-5,6-Dihydroxy-1,3-Diazepan-2-One; Aids-033355; Aids033355
• Molecular Formula: C₃₃H₃₂F₂N₂O₃
• Molecular Weight: 542.62
• CAS Registry Number: 153182-43-5
• SMILES: [C@@H]1(N(C(=O)N([C@@H]([C@H](O)[C@H]1O)CC2=CC=CC=C2)CC3=C(F)C=CC=C3)CC4=CC=CC=C4F)CC5=CC=CC=C5
• InChI: 1S/C33H32F2N2O3/c34-27-17-9-7-15-25(27)21-36-29(19-23-11-3-1-4-12-23)31(38)32(39)30(20-24-13-5-2-6-14-24)37(33(36)40)22-26-16-8-10-18-28(26)35/h1-18,29-32,38-39H,19-22H2/t29-,30-,31+,32+/m1/s1
• InChIKey: DCGZDWXALWANQB-ZRTHHSRSSA-N

Properties

• Density: 1.297g/cm³ (Cal.)
• Boiling point: 698.914°C at 760 mmHg (Cal.)
• Flash point: 376.49°C (Cal.)