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Substance Name: 1-Propanone, 3-(hexahydro-1H-azepin-1-yl)-1-(10H-phenothiazin-2-yl)-
RN: 89516-40-5
InChIKey: MKIRSERTEGYWKE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H24-N2-O-S

Molecular Weight

  • 352.4996
 
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Names and Synonyms

Synonyms

  • 3-(Hexahydro-1H-azepin-1-yl)-1-(10H-phenothiazin-2-yl)-1-propanone
  • BRN 4538072

Systematic Name

  • 1-Propanone, 3-(hexahydro-1H-azepin-1-yl)-1-(10H-phenothiazin-2-yl)-

Registry Numbers

CAS Registry Number

  • 89516-40-5

System Generated Number

  • 0089516405

Structure Descriptors

InChI

1S/C21H24N2OS/c24-19(11-14-23-12-5-1-2-6-13-23)16-9-10-21-18(15-16)22-17-7-3-4-8-20(17)25-21/h3-4,7-10,15,22H,1-2,5-6,11-14H2

InChIKey

MKIRSERTEGYWKE-UHFFFAOYSA-N

Smiles

O=C(CCN1CCCCCC1)c2ccc3Sc4ccccc4Nc3c2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 22, Pg. 952, 1983.