3-(azepan-1-yl)-1-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)propan-1-one,hydrochloride
Names
[ CAS No. ]:
21484-38-8
[ Name ]:
3-(azepan-1-yl)-1-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)propan-1-one,hydrochloride
[Synonym ]:
1-Propanone,3-(hexahydro-1H-azepin-1-yl)-1-(1,4,5,6-tetrahydro-1-phenyl-3-cyclopentapyrazolyl)-,monohydrochloride
Poli 95
3-(azepan-1-yl)-1-(1-phenyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)propan-1-one hydrochloride(1:1)
Chemical & Physical Properties
[ Molecular Formula ]:
C21H28ClN3O
[ Molecular Weight ]:
373.92000
[ Exact Mass ]:
373.19200
[ PSA ]:
38.13000
[ LogP ]:
4.54970
[ Vapour Pressure ]:
3.3E-11mmHg at 25°C
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UC2770000
- CHEMICAL NAME :
- 1-Propanone, 3-(hexahydro-1H-azepin-1-yl)-1-(1,4,5,6-tetrahydro-1- phenyl-3- cyclopentapyrazolyl)-, monohydrochloride
- CAS REGISTRY NUMBER :
- 21484-38-8
- LAST UPDATED :
- 198208
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C21-H27-N3-O.Cl-H
- MOLECULAR WEIGHT :
- 373.97
- WISWESSER LINE NOTATION :
- T55 BNN&TJ BR& DV2- AT7NTJ &GH
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 350 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 109,679,1970