63981-24-8

63981-24-8 structure

63981-24-8 structure

Name: (Z)-but-2-enedioic acid,N-[(4-chlorophenyl)-phenylmethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine
Chemical Name: (Z)-but-2-enedioic acid,N-[(4-chlorophenyl)-phenylmethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine
CAS Number: 63981-24-8
Molecular Formula: C₃₁H₃₄ClN₅O₈
Molecular Weight: 640.08300
Create Date: 2016-10-25 08:56:29
Modify Date: 2024-04-02 08:06:11

Name	(Z)-but-2-enedioic acid,N-[(4-chlorophenyl)-phenylmethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine
Synonyms	N-[(4-chlorophenyl)-phenylmethyl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamine (Z)-but-2-enedioic acid

Molecular Formula	C₃₁H₃₄ClN₅O₈
Molecular Weight	640.08300
Exact Mass	639.21000
PSA	193.49000
LogP	3.44860

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TL1860000

CHEMICAL NAME :: Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzylamino)ethyl)-4-(2-p yrimidyl)-, dimaleate

CAS REGISTRY NUMBER :: 63981-24-8

LAST UPDATED :: 199107

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C23-H26-Cl-N5.2C4-H4-O4

MOLECULAR WEIGHT :: 640.15

WISWESSER LINE NOTATION :: T6N DNTJ A2MYR&R DG& D- BT6N CNJ &QV1U1VQ 2 -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 :: 150 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