4-phenyl-3-(2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thione
Names
[ CAS No. ]:
128368-39-8
[ Name ]:
4-phenyl-3-(2-pyrrolidin-1-ylethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine-2-thione
Chemical & Physical Properties
[ Density]:
1.34g/cm3
[ Boiling Point ]:
589.3ºC at 760 mmHg
[ Molecular Formula ]:
C22H25N3S2
[ Molecular Weight ]:
395.58400
[ Flash Point ]:
310.2ºC
[ Exact Mass ]:
395.14900
[ PSA ]:
81.39000
[ LogP ]:
5.40680
[ Vapour Pressure ]:
7.29E-14mmHg at 25°C
[ Index of Refraction ]:
1.731
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DL8351000
- CHEMICAL NAME :
- (1)Benzothieno(2,3-d)pyrimidine-2(3H)-thione, 5,6,7,8-tetrahydro-4-phenyl-3-(2- pyrrolidinyl)ethyl)-
- CAS REGISTRY NUMBER :
- 128368-39-8
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C22-H25-N3-S2
- MOLECULAR WEIGHT :
- 395.62
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 :
- >1500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARPMAS Archiv der Pharmazie (Weinheim, Germany) (VCH Pub., Inc., 303 NW 12th Ave., Deerfield Beach, FL 33441) V.51-261, 1835-1923; V.305- 1972- Volume(issue)/page/year: 327,779,1994
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 26,323,1991