Watanidipine

5-O-[2-[4-(4-benzhydrylpiperazin-1-yl)phenyl]ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Also Known As: Vatanidipine|Watanidipine|vatanidipino|vatanidipinum|Harmol|Vatanidipine [INN]|Watanidipine dihydrochloride|AE0047|AE-0047|CS-AD-00587|Tox21_113741|AE 0047|AN-5727|NCGC00253607-01|CAS-116308-55-5|VATANIDIPINE HYDROCHLORIDE (Watanidipin)|3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-(4-(4-(diphenylmethyl)-1-piperazinyl)phenyl)ethyl methyl ester|5-O-[2-[4-(4-benzhydrylpiperazin-1-yl)phenyl]ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate|(+-)-p-(4-(Diphenylmethyl)-1-piperazinyl)phenethyl)methyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicaboxylate|(+-)-p-(4-(Diphenylmethyl)-1-piperazinyl)phenethyl)methyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylate|2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-[4-(4-benzhydryl-1-piperazinyl)phenethyl]5-methyl ester|2-(4-(4-benzhydryl-1-piperazinyl)phenyl)ethyl methyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyrdinedicarboxylate hydrochloride|(+/-)-P-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)PHENETHYL)METHYL 1,4-DIHYDRO-2,6-DIMETHYL-4-(M-NITROPHENYL)-3,5-PYRIDINEDICARBOXYLATE

Molecular Formula	C41H42N4O6
Molecular Weight	686.3104 g/mol
LogP	6.7
Topological Polar Surface Area	114.25 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	11
Exact Mass	686.3104
Heavy Atoms	51
Complexity	1894.4

Chemical Identifiers

CAS Number	116308-55-5
SMILES	CC1=C(C(C(=C(N1)C)C(=O)OCCC2=CC=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC(=CC=C6)[N+](=O)[O-])C(=O)OC