chempirical

Lercanidipine hydrochloride

C36H42ClN3O6CAS 132866-11-6648.20 g/mol

Open in Covalent MOL file
OONHOONN+OO−HCl
AlkeneEsterNitroSecondary amineTertiary amine

Properties

Molecular formula
C36H42ClN3O6
Molar mass
648.20 g/mol
Exact mass
647.2762 Da
logP
6.90Crippen estimate
Polar surface area
111.0 Ų
H-bond donors / acceptors
1 / 8
Rotatable bonds
12

Identifiers

CAS number
132866-11-6
SMILES
COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)(C)CN(C)CCC(c2ccccc2)c2ccccc2)C1c1cccc([N+](=O)[O-])c1.Cl
InChIKey
WMFYOYKPJLRMJI-UHFFFAOYSA-N
InChI
InChI=1S/C36H41N3O6.ClH/c1-24-31(34(40)44-6)33(28-18-13-19-29(22-28)39(42)43)32(25(2)37-24)35(41)45-36(3,4)23-38(5)21-20-30(26-14-9-7-10-15-26)27-16-11-8-12-17-27;/h7-19,22,30,33,37H,20-21,23H2,1-6H3;1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

19 names · show all
  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-[2-[(3,3-diphenylpropyl)methylamino]-1,1-dimethylethyl] 5-methyl ester, hydrochloride (1:1)
  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-[(3,3-diphenylpropyl)methylamino]-1,1-dimethylethyl methyl ester, monohydrochloride
  • Carmen
  • Renovia
  • Cardiovasc
  • Lercaton
  • Vasodip
  • Zandip
  • Lercapin
  • Corifeo
  • Lerkamen
  • Lercan
  • Zanicor
  • Lerzam
  • Lercadip
  • Rec 15/2375
  • R 75
  • Lotensyl
  • Lervasc

Work with Lercanidipine hydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Nicardipine hydrochloride54527-84-366 % similar Nicardipine55985-32-562 % similar Manidipine dihydrochloride89226-75-561 % similar Benidipine hydrochloride91599-74-559 % similar Nitrendipine39562-70-457 % similar Manidipine120092-68-457 % similar Manidipine89226-50-657 % similar Barnidipine104713-75-957 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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