AH 21-132

N-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;bis((E)-but-2-enedioic acid)

Also Known As: Benafentrine dimaleate|AH 21132|AH-21-132|AH 21-132|Benafentrine dimaleate < Rec INNM >|SID:134224223|Acetamide, N-(4-(1,2,3,4,4a,10b-hexahydro-8,9-dimethoxy-2-methylbenzo(c)(1,6)naphthyridin-6-yl)phenyl)-, cis-, (Z)-2-butenedioate (1:2)|N-[4-[(4Ar,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;(E)-but-2-enedioic acid|6-(4-Acetamidophenyl)-1,2,3,4,4a,10b-hexahydro-8,9-dimethoxy-2-methylbenzo(c)(1,6)-naphthyridine-bis(hydrogen maleate)|ACETAMIDE,N-[4-[(4AR,10BS)-1,2,3,4,4A,10BHEXAHYDRO- 8,9-DIMETHOXY-2-METHYLBENZO[C][1,- 6]NAPHTHYRIDIN-6-YL]PHENYL]-,REL-,(2Z)-2-BUTENEDIOATE (1:2)|Cis-4'-(1,2,3,4,4a,10b-Hexahydro-8,9-dimethoxy-2-methylbenzo[c][1,6]naphthyridin-6-yl)acetanilide bis(hydrogenmaleate)|Cis-6-(4-Acetamidophenyl)-8,9-dimethoxy-2-methyl-1,2,3,4,4a,10b-hexahydrobenzo[c][1,6]naphthyridine bis(hydrogenmaleate)|Cis-N-[4-(1,2,3,4,4a,10b-Hexahydro-8,9-dimethoxy-2-methylbenzo[c][1,6]naphthyridin-6-yl)phenyl]acetamide (Z)-2-butenedioate (1:2)|N-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide,(E)-but-2-enedioic acid|N-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide; (E)-but-2-enedioic acid

Molecular Formula	C31H35N3O11
Molecular Weight	625.2272 g/mol
LogP	2.7245
Topological Polar Surface Area	212.36 Ų
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	9
Rotatable Bonds	8
Exact Mass	625.2272
Monoisotopic Mass	625.2272
Heavy Atoms	45
Complexity	1430.8458

Chemical Identifiers

CAS Number	76166-55-7
SMILES	CC(=O)NC1=CC=C(C=C1)C2=N[C@H]3[C@@H](C4=CC(=C(C=C24)OC)OC)CN(CC3)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O