3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, ethyl methyl ester, (4R)-
Basic information
- CAS
80890-07-9- Standard SMILES
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)[C@H]1c1cccc([N+](=O)[O-])c1- InChIKey
PVHUJELLJLJGLN-MRXNPFEDSA-N- Molecular formula
- C18H20N2O6
- Average molar mass
- 360.4 g/mol
- Monoisotopic mass
- 360.13213636
Names & identifiers
- Preferred name
- 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, ethyl methyl ester, (4R)-
- IUPAC
- 5-O-ethyl 3-O-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
- English name
- (+)-Nitrendipine
- Molecular formula
- C18H20N2O6
- Molecular weight
- 360.36
Names & synonyms
80890-07-9(+)-Nitrendipine(R)-NITRENDIPINENitrendipine, (R)-3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, ethyl methyl ester, (4R)-20VJ8H4MNI5-O-ethyl 3-O-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate3-Ethyl 5-methyl (R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate(+)-BAY-E-5009Tocris-0601Lopac-N-144Nitrendipine Impurity 43
Show more names
Nitrendipine Impurity1219PVHUJELLJLJGLN-MRXNPFEDSA-N(R)-2,6-Dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-methyl 5-ethyl ester3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, ethyl methyl ester, (R)-[R,(+)]-2,6-Dimethyl-4β-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-methyl 5-ethyl ester
UNII-20VJ8H4MNISCHEMBL38973CHEMBL268609(+)-(R)-NITRENDIPINE(R)-(+)-NITRENDIPINESCHEMBL30228952DTXSID70230776NCGC00015713-01
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 661
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- FDA UNII
- 20 VJ8H4MNI · 20VJ8H4MNI
Chemistry & industry
Pharmacology
Metabolism/Metabolites3,5-pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, ethyl methyl ester, (4r)- has known human metabolites that include Nitrendipine M (dehydro).
Applications
Uses(+)-Nitrendipine is used in the treatment of hypertension for the regulation of blood pressure. A dihydropyridine calcium channel blocker.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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