Benidipine Hydrochloride
5-O-[(3R)-1-benzylpiperidin-3-yl] 3-O-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;hydrochloride
Molecular Identity
Benidipine Hydrochloride
5-O-[(3R)-1-benzylpiperidin-3-yl] 3-O-methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;hydrochloride
PubChem CID: 656667
2D Structure
Properties
C28H32ClN3O6
Molecular Formula
542.00
Molecular Weight
g/mol
541.1980
Exact Mass
Da
114
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
8
H-Bond Acceptors
933
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(C(C(=C(N1)C)C(=O)OC2CCCN(C2)CC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC.ClIsomeric SMILES
SMILES: CC1=C([C@H](C(=C(N1)C)C(=O)O[C@@H]2CCCN(C2)CC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)OC.ClSynonyms(20)
benidipine hydrochloride91599-74-5KW-30490A6746FWDLRefChem:5612501,4 Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid methyl 1-(phenylmethyl)-3-piperidinyl ester hclConielBENIDIPINE HClrac Benidipine hydrochloride129262-07-3MFCD00906929Benidipine hydrochloride [JAN]DTXSID2049050Benidipine (hydrochloride)(3R)-1-Benzyl-3-piperidinyl methyl (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate hydrochloride (1:1)
Data from PubChem (NCBI)
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