Lanabecestat
[CAS# 1383982-64-6]

Identification

• Name: Lanabecestat
• Synonyms: (1r,4r)-4-methoxy-5''-methyl-6'-(5-(prop-1-yn-1-yl)pyridin-3-yl)-3'H-dispiro[cyclohexane-1,2'-indene-1',2''-imidazol]-4''-amine; 4-methoxy-5'-methyl-6'-(5-(prop-1-yn-1-yl)pyridin-3-yl)-3'H-dispiro(cyclohexane-1,2'-inden-1',2'-imidazol)-4'-amine; AZD3293; AZD 3293; AZD-3293
• Molecular Formula: C₂₆H₂₈N₄O
• Molecular Weight: 412.53
• CAS Registry Number: 1383982-64-6
• SMILES: CC#CC1=CC(=CN=C1)C2=CC3=C(CC4(C35N=C(C(=N5)N)C)CCC(CC4)OC)C=C2
• InChI: 1S/C26H28N4O/c1-4-5-18-12-21(16-28-15-18)19-6-7-20-14-25(10-8-22(31-3)9-11-25)26(23(20)13-19)29-17(2)24(27)30-26/h6-7,12-13,15-16,22H,8-11,14H2,1-3H3,(H2,27,30)/t22?,25?,26-/m0/s1
• InChIKey: WKDNQONLGXOZRG-BOPKNSRXSA-N

Properties

• Density: 1.23±0.1g/cm³ (Expl.)
• Boiling point: 621.9±65.0°C at 760 Torr (Expl.)
• solubility: DMSO