(Z)-but-2-enedioic acid,2-[4-[2-[(4-chlorophenyl)-phenylmethyl]sulfanylethyl]piperazin-1-yl]pyrimidine

Names

[ CAS No. ]:
63978-28-9

[ Name ]:
(Z)-but-2-enedioic acid,2-[4-[2-[(4-chlorophenyl)-phenylmethyl]sulfanylethyl]piperazin-1-yl]pyrimidine

[Synonym ]:
Pyrimidine,2-(4-(2-(((4-chlorophenyl)phenylmethyl)thio)ethyl)-1-piperazinyl)-,maleate
(Z)-but-2-enedioic acid
2-[4-[2-[(4-chlorophenyl)-phenylmethyl]sulfanylethyl]piperazin-1-yl]pyrimidine

Chemical & Physical Properties

[ Molecular Formula ]:
C27H29ClN4O4S

[ Molecular Weight ]:
541.06200

[ Exact Mass ]:
540.16000

[ PSA ]:
132.16000

[ LogP ]:
4.48950

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TL2520000
CHEMICAL NAME :
Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzylthio)ethyl)-4-(2-py rimidyl)-, maleate
CAS REGISTRY NUMBER :
63978-28-9
LAST UPDATED :
199107
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C23-H25-Cl-N4-S.C4-H4-O4
MOLECULAR WEIGHT :
541.11
WISWESSER LINE NOTATION :
T6N DNTJ A2SYR&R DG& D- BT6N CNJ &QV1U1VQ -C

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 :
800 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
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: 12,860,1969

Related Compounds

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 3-Methyl-4-(4-propan-2-ylpiperazin-1-yl)aniline
  • N-(2-chlorobenzyl)-2-((3-(3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl)pyridin-2-yl)thio)acetamide
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 3-Methoxy-3-methyl-1,4-dioxan-2-ol
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde