Chemical Properties of Diphenoxylate (CAS 915-30-0)

Diphenoxylate

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InChI
InChI=1S/C30H32N2O2/c1-2-34-28(33)29(25-12-6-3-7-13-25)18-21-32(22-19-29)23-20-30(24-31,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17H,2,18-23H2,1H3
InChI Key
HYPPXZBJBPSRLK-UHFFFAOYSA-N
Formula
C30H32N2O2
SMILES
CCOC(=O)C1(c2ccccc2)CCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1
Molecular Weight1
452.59
CAS
915-30-0
Other Names
  • 1-(3-Cyano-3,3-diphenylpropyl)-4-phenyl-isonipecotic acid ethyl ester
  • 4-Piperidinecarboxylic acid, 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-, ethyl ester
  • Diphenoxalate
  • Ethyl-1-(3-cyano-3,3-diphenylpropyl)-4-phenylisonipecotate
  • Isonipecotic acid, 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-, ethyl ester
  • Lomotil
  • R-1132
Sources

Physical Properties

Property Value Unit Source
logPoct/wat 5.48 Crippen Calculated Property

Similar Compounds

4-Ethoxycarbonyl-alpha,alpha,4-triphenyl-1-piperidinebutyronitrile, hydrochloride. DIFENOXIN. Etoxeridine. Phenoperidine. Properidine. Benzethidine. Hydroxypethidine. Furethidine. Dioxaphetyl butyrate. 4-Piperidinecarboxylic acid, 4-phenyl-, ethyl ester. Ethoheptazine. Pentanoic acid,2,2-diphenyl-,diethylaminoethyl ester, hydrochloride. Acetic acid, propyldiphenyl-, 2-(diethylamino)ethyl ester. 2(3H)- benzofuranone, 3-phenyl-3-(2-piperidinoethyl)-. 3-(Beta-morpholinoethyl)-3-phenyl-2-benzofuranone.

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