Compound: nilvadipine
SMILES: O=[N+]([O-])c1cc(ccc1)C2C(=C(NC(=C2C(=O)OC(C)C)C)C#N)C(=O)OC
InChIKey: FAIIFDPAEUKBEP-UHFFFAOYSA-N
Synonyms: nilvadipine, 75530-68-6, Escor, Nivadil, Nivadipine, FR-34235, Nilvadipino, Nivadip, FK 235, Nilvadipinum, Dl-nilvadipine, FK-235, SK&F 102,362, CL 287,389, SK&F-102362, CL-287389, DTXSID2046624, SK&F-102,362, 0214FUT37J, CL-287,389, SKF-102362, 3,5-Pyridinedicarboxylic acid, 2-cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-, 3-methyl 5-(1-methylethyl) ester, DTXCID0026624, 3-methyl 5-propan-2-yl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, RefChem:854152, C08CA10, 3-Methyl 5-(1-methylethyl) (4RS)-2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 805-887-5, MFCD00867065, FR 34235, Nilvadipine (ARC029), 3-O-methyl 5-O-propan-2-yl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 5-isopropyl 3-methyl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 5-Isopropyl 3-methyl 2-cyano-1,4-dihydro-6-methyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylate, 2-Cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 3-methyl 5-(1-methylethyl) ester, NCGC00167435-01, Nilvadipinum [Latin], Nilvadipino [Spanish], Nilvadipine [USAN:INN:JAN], BRN 3572609, UNII-0214FUT37J, Nivadil (TN), Nilvadipine (Standard), NILVADIPINE [MI], NILVADIPINE [INN], NILVADIPINE [JAN], NILVADIPINE [USAN], NILVADIPINE [MART.], SCHEMBL33729, (+/-)-NILVADIPINE, NILVADIPINE [WHO-DD], CHEMBL517427, orb1308664, SCHEMBL30875962, CHEBI:31911, FAIIFDPAEUKBEP-UHFFFAOYSA-, GTPL10160, Nilvadipine (JP18/USAN/INN), GLXC-07210, HMS3651J11, HMS3714A17, HMS3884F16, HMS5081B15, ARC029;FR34235, Tox21_112439, BDBM50103634, EBC-26884, HY-14284R, MSK163084, AKOS015907577, CCG-220648, DB06712, FR34235, KS-1303, NCGC00167435-02, NCGC00167435-03, NCGC00167435-07, 2-Cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid 5-Isopropyl 3-Methyl Ester, 3,5-Pyridinedicarboxylic acid, 2-cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-, 3-methyl-5-(1-methylethyl) ester, 5-Isopropyl 3-Methyl 2-Cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate, AC-28326, HY-14284, O5-isopropyl O3-methyl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, SY105970, CAS-75530-68-6, DB-055963, N0899, NS00003603, S2721, SW219572-1, D01908, SBI-0636225.0001, AB01566895_01, EN300-19767511, SR-01000872715, Q7037489, SR-01000872715-1, BRD-A84687895-001-03-2, BRD-A84687895-001-04-0, O3-methyl O5-propan-2-yl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-, (+)-5-isopropyl 3-methyl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 3-Methyl 5-(propan-2-yl) 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 5-isopropyl 3-methyl (+)-2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 5-isopropyl 3-methyl (-)-2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 5-Isopropyl3-methyl 2-cyano-1,4-dihydro-6-methyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylate, InChI=1/C19H19N3O6/c1-10(2)28-19(24)15-11(3)21-14(9-20)17(18(23)27-4)16(15)12-6-5-7-13(8-12)22(25)26/h5-8,10,16,21H,1-4H3
Theoretical properties:
molecular_formula: C19H19N3O6
molecular_weight: 385.4 g/mol
exact_mass: 385.12738533 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 8
rotatable_bond_count: 6
heavy_atom_count: 28
topological_polar_surface_area: 134 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Nilvadipine is a nitrile, a methyl ester, an isopropyl ester and a dihydropyridine.
chembl: NILVADIPINE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 3.0.
wikipedia: Nilvadipine is a calcium channel blocker (CCB) used for the treatment of hypertension and chronic major cerebral artery occlusion. 
Pathohistochemical studies have revealed that the volume of the infarction in the middle cerebral artery occlusion model could be decreased by nilvadipine.