ALMOREXANT

CAS No.
913358-93-7 ;871224-64-5
CCD No.
CCD01017740
Formula
C29 H31 F3 N2 O3
MolWeight
512.569

Basic Information

Product Name: ALMOREXANT
CAS: 913358-93-7 ;871224-64-5
English Synonyms: (R)-2-((R)-6,7-DIMETHOXY-1-(4-(TRIFLUOROMETHYL)PHENETHYL)-3,4-DIHYDROISOQUINOLIN-2(1H)-YL)-N-METHYL-2-PHENYLACETAMIDE ; ALMOREXANT
MDL Number.: MFCD11110686
H bond acceptor: 5
H bond donor: 1
Smile: CNC(=O)[C@@H](c1ccccc1)N2CCc3cc(c(cc3[C@H]2CCc4ccc(cc4)C(F)(F)F)OC)OC
InChi: InChI=1S/C29H31F3N2O3/c1-33-28(35)27(20-7-5-4-6-8-20)34-16-15-21-17-25(36-2)26(37-3)18-23(21)24(34)14-11-19-9-12-22(13-10-19)29(30,31)32/h4-10,12-13,17-18,24,27H,11,14-16H2,1-3H3,(H,33,35)/t24-,27-/m1/s1
InChiKey: InChIKey=DKMACHNQISHMDN-SHQCIBLASA-N

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