3-[4-(3-methylsulfonyl-11-oxo-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-oxidopiperazin-1-ium-1-yl]propan-1-ol

Names

[ CAS No. ]:
74667-83-7

[ Name ]:
3-[4-(3-methylsulfonyl-11-oxo-5,6-dihydrobenzo[b][1]benzothiepin-5-yl)-1-oxidopiperazin-1-ium-1-yl]propan-1-ol

Chemical & Physical Properties

[ Molecular Formula ]:
C₂₂H₂₈N₂O₅S₂

[ Molecular Weight ]:
464.59800

[ Exact Mass ]:
464.14400

[ PSA ]:
131.70000

[ LogP ]:
3.70980

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TM2670490

CHEMICAL NAME :: 1-Piperazinepropanol, 4-(10,11-dihydro-8-(methylsulfonyl)dibenzo(b,f)thiepi n-10-yl)-, S,1-dioxide

CAS REGISTRY NUMBER :: 74667-83-7

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C22-H28-N2-O5-S2

MOLECULAR WEIGHT :: 464.64

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 400 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 45,529,1980

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

1-Piperazinepropanol
10-[4-(3-Hydroxypropyl)piperazino]-8-(methylsulfonyl)-10,11-dihydrodibenzo[b,f]thiepin

DownStream