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Substance Name: Morpholine, 4-(3-((3,5-dichlorophenyl)-4-pyridinylamino)-1-oxopropyl)-2,6-dimethyl-, hydrochloride, hydrate
RN: 59235-76-6
InChIKey: CMYKPAMSLQYGEG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-Cl2-N3-O2.Cl-H.H2-O

Molecular Weight

  • 444.7876
 
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Names and Synonyms

Synonym

  • 4-(3-((3,5-Dichlorophenyl)-4-pyridinylamino)-1-oxopropyl)-2,6-dimethylmorpholine HCl H2O

Systematic Name

  • Morpholine, 4-(3-((3,5-dichlorophenyl)-4-pyridinylamino)-1-oxopropyl)-2,6-dimethyl-, hydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 59235-76-6

System Generated Number

  • 0059235766

Molecular Formulas

Molecular Formula

  • C20-H23-Cl2-N3-O2.Cl-H.H2-O

Molecular Formula Fragments

  • C20-H23-Cl2-N3-O2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C20H23Cl2N3O2.ClH/c1-14-12-24(13-15(2)27-14)20(26)5-8-25(18-3-6-23-7-4-18)19-10-16(21)9-17(22)11-19;/h3-4,6-7,9-11,14-15H,5,8,12-13H2,1-2H3;1H

InChIKey

CMYKPAMSLQYGEG-UHFFFAOYSA-N

Smiles

CC1CN(CC(O1)C)C(=O)CCN(c2ccncc2)c3cc(cc(c3)Cl)Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 45mg/kg (45mg/kg)   United States Patent Document. Vol. #3928341,