Molecular Identity
Azelnidipine
3-O-(1-benzhydrylazetidin-3-yl) 5-O-propan-2-yl 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
PubChem CID: 65948
Azelnidipine is an isopropyl ester.
2D Structure
Properties
C33H34N4O6
Molecular Formula
582.60
Molecular Weight
g/mol
582.2478
Exact Mass
Da
6
XLogP
Above Lipinski threshold
140
TPSA
May have limited oral absorption
2
H-Bond Donors
9
H-Bond Acceptors
1080
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(C(C(=C(N1)N)C(=O)OC2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC(C)CIsomeric SMILES
SMILES: CC1=C(C(C(=C(N1)N)C(=O)OC2CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)OC(C)CSynonyms(20)
Azelnidipine123524-52-7CalblockCS-905DTXSID3020120AzelnidipinoPV23P19YUGCS905DTXCID501203,5-Pyridinedicarboxylic acid, 2-amino-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-, 3-(1-(diphenylmethyl)-3-azetidinyl) 5-(1-methylethyl) ester, (+-)-3-[1-(DIPHENYLMETHYL)AZETIDIN-3-YL] 5-PROPAN-2-YL 2-AMINO-6-METHYL-4-(3-NITROPHENYL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATEazelnidipinum3-(1-(diphenylmethyl)azetidin-3-yl) 5-propan-2-yl 2-amino-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylateRefChem:5604763-(1-diphenylmethylazetidin-3-yl)-5-isopropyl-2-amino-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Azelnidipine
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