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Substance Name: 4-Piperidinol, 1-(3-(10,11-dihydro-5H-dibenz(b,f)azepin-5-yl)propyl)-4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, monohydrochloride
RN: 28027-87-4
InChIKey: GGVJQZOBUMPVCH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H31-F3-N2-O.Cl-H

Molecular Weight

  • 517.032
 
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Names and Synonyms

  • 4-Piperidinol, 1-(3-(10,11-dihydro-5H-dibenz(b,f)azepin-5-yl)propyl)-4-(alpha,alpha,alpha-trifluoro-m-tolyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 28027-87-4

System Generated Number

  • 0028027874

Molecular Formulas

Molecular Formula

  • C29-H31-F3-N2-O.Cl-H

Molecular Formula Fragments

  • C29-H31-F3-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H31F3N2O.ClH/c30-29(31,32)25-10-5-9-24(21-25)28(35)15-19-33(20-16-28)17-6-18-34-26-11-3-1-7-22(26)13-14-23-8-2-4-12-27(23)34;/h1-5,7-12,21,35H,6,13-20H2;1H

InChIKey

GGVJQZOBUMPVCH-UHFFFAOYSA-N

Smiles

N1(CCC(CC1)(O)c1cc(ccc1)C(F)(F)F)CCCN1c2c(CCc3c1cccc3)cccc2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 80mg/kg (80mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 644, 1970.