chempirical

Loperamide hydrochloride

C29H34Cl2N2O2CAS 34552-83-5513.50 g/mol

Open in Covalent MOL file
NONOHClHCl
AlcoholAmideAryl halideTertiary amine

Properties

Molecular formula
C29H34Cl2N2O2
Molar mass
513.50 g/mol
Exact mass
512.1997 Da
Melting point
222–223 °C
logP
5.51Crippen estimate
Polar surface area
43.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
7

Identifiers

CAS number
34552-83-5
SMILES
CN(C)C(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1.Cl
InChIKey
PGYPOBZJRVSMDS-UHFFFAOYSA-N
InChI
InChI=1S/C29H33ClN2O2.ClH/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23;/h3-16,34H,17-22H2,1-2H3;1H

Weigh it out

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

Names and synonyms

23 names · show all
  • 1-Piperidinebutanamide, 4-(4-chlorophenyl)-4-hydroxy-N,N-dimethyl-α,α-diphenyl-, hydrochloride (1:1)
  • 1-Piperidinebutanamide, 4-(4-chlorophenyl)-4-hydroxy-N,N-dimethyl-α,α-diphenyl-, monohydrochloride
  • 4-(p-Chlorophenyl)-4-hydroxy-N,N-dimethyl-α,α-diphenyl-1-piperidinobutyramide hydrochloride
  • R 18553
  • Lopemin
  • Imodium
  • Loperazine
  • Lopodium
  • PJ 185
  • Arret
  • Imosec
  • Fortasec
  • Maalox antidiarrheal
  • Imossel
  • Blox
  • Tebloc
  • Dissenten
  • Suprasec
  • Loperyl
  • Brek
  • Lopemid
  • Imodium A-D
  • NSC 696356

Work with Loperamide 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

Loperamide53179-11-694 % similar Haloperidol52-86-845 % similar 4-(4-Chlorophenyl)-4-hydroxypiperidine39512-49-737 % similar 1-(4-Chlorophenyl)-1-phenylethanol59767-24-735 % similar 1-(4-Chlorophenyl)cyclopropanecarboxylic acid72934-37-335 % similar Diphenidol hydrochloride3254-89-534 % similar Chlophedianol hydrochloride511-13-734 % similar Levocetirizine dihydrochloride130018-87-033 % similar

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

Elsewhere

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