7H-1,2,4-Triazolo(3,4-b)(1,3,4)thiadiazine-7-acetic acid, 3-(3,5-dimet hoxyphenyl-4-ethoxyphenyl)-6-(4-fluorophenyl)-
Names
[ CAS No. ]:
126598-18-3
[ Name ]:
7H-1,2,4-Triazolo(3,4-b)(1,3,4)thiadiazine-7-acetic acid, 3-(3,5-dimet hoxyphenyl-4-ethoxyphenyl)-6-(4-fluorophenyl)-
Chemical & Physical Properties
[ Density]:
1.44g/cm3
[ Boiling Point ]:
689.8ºC at 760 mmHg
[ Molecular Formula ]:
C22H21FN4O5S
[ Molecular Weight ]:
472.48900
[ Flash Point ]:
371ºC
[ Exact Mass ]:
472.12200
[ PSA ]:
133.36000
[ LogP ]:
3.13710
[ Vapour Pressure ]:
5.62E-20mmHg at 25°C
[ Index of Refraction ]:
1.656
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XZ6158222
- CHEMICAL NAME :
- 7H-1,2,4-Triazolo(3,4-b)(1,3,4)thiadiazine-7-acetic acid, 3-(3,5-dimethoxyphenyl- 4-ethoxyphenyl)-6-(4-fluorophenyl)-
- CAS REGISTRY NUMBER :
- 126598-18-3
- LAST UPDATED :
- 199206
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C22-H21-F-N4-O5-S
- MOLECULAR WEIGHT :
- 472.53
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 :
- >1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 44,933,1989
- 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 :
- FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 44,933,1989