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Substance Name: BTM 1086
RN: 87687-13-6
InChIKey: AYKFZKNEQPYCSY-XLCHORMMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N3-O-S.Cl-H

Molecular Weight

  • 403.9754
 
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Names and Synonyms

Results Name

  • BTM 1086

Synonym

  • BTM 1086

Systematic Name

  • 1,5-Benzothiazepin-4(5H)-one, 2,3-dihydro-3-((4-methyl-1-piperazinyl)methyl)-2-phenyl-, monohydrochloride, cis-(-)-

Registry Numbers

CAS Registry Number

  • 87687-13-6

Related Registry Number

  • 72293-40-4 (Parent)

System Generated Number

  • 0087687136

Molecular Formulas

Molecular Formula

  • C21-H25-N3-O-S.Cl-H

Molecular Formula Fragments

  • C21-H25-N3-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25N3OS.ClH/c1-23-11-13-24(14-12-23)15-17-20(16-7-3-2-4-8-16)26-19-10-6-5-9-18(19)22-21(17)25;/h2-10,17,20H,11-15H2,1H3,(H,22,25);1H/t17-,20+;/m1./s1

InChIKey

AYKFZKNEQPYCSY-XLCHORMMSA-N

Smiles

Cl.CN1CCN(C[C@@H]2[C@@H](Sc3ccccc3NC2=O)c4ccccc4)CC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 113mg/kg (113mg/kg)   Japanese Journal of Pharmacology. Vol. 41, Pg. 283, 1986.
rat LD50 oral 830mg/kg (830mg/kg)   Japanese Journal of Pharmacology. Vol. 41, Pg. 283, 1986.
rat LD50 subcutaneous 630mg/kg (630mg/kg)   Japanese Journal of Pharmacology. Vol. 41, Pg. 283, 1986.