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Chemical structure of Manidipine 2HCl

GC15293

Manidipine 2HCl

Also known as 5-O-[2-(4-benzhydrylpiperazin-1-yl)ethyl] 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate;dihydrochloride

Manidipine 2HCl (CV-4093) is a dihydropyridine compound and a calcium channel blocker for Ca2+ current with IC50 of 2·6 nM

ChemicalCAS89226-75-5MW683.62FormulaC35H40Cl2N4O6
CAS number
89226-75-5
Molecular weight
683.62
Formula
C35H40Cl2N4O6
Solubility
≥ 69mg/mL in DMSO with gentle warming, ≥ 69·2mg/mL in EtOH with gentle warming
InChIKey
JINNGBXKBDUGQT-UHFFFAOYSA-N
Catalogue number
GC15293
Brand
GLPBIO
Computed properties PubChem CID 150762 · TPSA 117 Ų · H-bond donors 3 · H-bond acceptors 9
TPSA
117 Ų
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
11
Heavy atoms
47

SMILES CC1=C(C(C(=C(N1)C)C(=O)OCCN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC.Cl.Cl

Computed descriptors from PubChem (CID 150762), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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