2-benzylsulfanyl-3-(2-chlorophenyl)pyrimidin-4-one

Modify Date: 2024-01-11 13:51:53

2-benzylsulfanyl-3-(2-chlorophenyl)pyrimidin-4-one Structure
2-benzylsulfanyl-3-(2-chlorophenyl)pyrimidin-4-one structure
 Common Name 2-benzylsulfanyl-3-(2-chlorophenyl)pyrimidin-4-one
CAS Number 89069-57-8 Molecular Weight 328.81600
Density N/A Boiling Point N/A
Molecular Formula C17H13ClN2OS Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-benzylsulfanyl-3-(2-chlorophenyl)pyrimidin-4-one

 Chemical & Physical Properties

Molecular Formula C17H13ClN2OS
Molecular Weight 328.81600
Exact Mass 328.04400
PSA 60.19000
LogP 4.17820
InChIKey DTZFCFPSVBKHGH-UHFFFAOYSA-N
SMILES O=c1ccnc(SCc2ccccc2)n1-c1ccccc1Cl

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UW7387800
CHEMICAL NAME :
4(3H)-Pyrimidinone, 3-(2-chlorophenyl)-2-((phenylmethyl)thio)-
CAS REGISTRY NUMBER :
89069-57-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H13-Cl-N2-O-S
MOLECULAR WEIGHT :
328.83

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - ataxia Behavioral - analgesia
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 22,789,1983
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Chemsrc provides CAS#:89069-57-8 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-benzylsulfanyl-3-(2-chlorophenyl)pyrimidin-4-one>> amp version: 2-benzylsulfanyl-3-(2-chlorophenyl)pyrimidin-4-one

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