Acetamide, N-[5,6,7,9-tetrahydro-1,2, 3-trimethoxy-9-oxo-10-[(phenylmethyl)thio]benzo[c]heptalen-7-yl]-, (S)-
Names
[ CAS No. ]:
76129-12-9
[ Name ]:
Acetamide, N-[5,6,7,9-tetrahydro-1,2, 3-trimethoxy-9-oxo-10-[(phenylmethyl)thio]benzo[c]heptalen-7-yl]-, (S)-
[Synonym ]:
N-[(S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-9-oxo-10-(benzylthio)benzo[a]heptalen-7-yl]acetamide
N-[(S)-5,6,7,9-Tetrahydro-1,2,3-trimethoxy-10-benzylthio-9-oxobenzo[a]heptalen-7-yl]acetamide
10-(Benzylthio)-10-demethoxycolchicine
(S)-7-Acetylamino-10-benzylmercapto-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-on
N-((S)-10-Benzylmercapto-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamid
10-benzylthiocolchicine
N-((S)-10-benzylsulfanyl-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-7-yl)-acetamide
Chemical & Physical Properties
[ Density]:
1.27g/cm3
[ Boiling Point ]:
787.6ºC at 760 mmHg
[ Molecular Formula ]:
C28H29NO5S
[ Molecular Weight ]:
491.59900
[ Flash Point ]:
430.1ºC
[ Exact Mass ]:
491.17700
[ PSA ]:
99.16000
[ LogP ]:
5.54620
[ Index of Refraction ]:
1.634
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AC8756000
- CHEMICAL NAME :
- Acetamide, N-(5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxo-10-((phe nylmethyl)thio)benzo( a) heptalen-7-yl)-, (S)-
- CAS REGISTRY NUMBER :
- 76129-12-9
- BEILSTEIN REFERENCE NO. :
- 3185560
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C28-H29-N-O5-S
- MOLECULAR WEIGHT :
- 491.64
- WISWESSER LINE NOTATION :
- L B677 MV&T&J CO1 DO1 ES1R& JMV1 NO1
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 :
- 30 mg/kg
- TOXIC EFFECTS :
- Tumorigenic - active as anti-cancer agent
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 24,636,1981