21484-38-8

21484-38-8 structure

21484-38-8 structure

Name: 3-(azepan-1-yl)-1-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)propan-1-one,hydrochloride
Chemical Name: 3-(azepan-1-yl)-1-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)propan-1-one,hydrochloride
CAS Number: 21484-38-8
Molecular Formula: C₂₁H₂₈ClN₃O
Molecular Weight: 373.92000
Create Date: 2016-07-20 17:59:31
Modify Date: 2024-04-07 17:55:28

Name	3-(azepan-1-yl)-1-(1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl)propan-1-one,hydrochloride
Synonyms	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)

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

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