68352-95-4

68352-95-4 structure

68352-95-4 structure

Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butanoic acid
Chemical Name: 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butanoic acid
CAS Number: 68352-95-4
Molecular Formula: C₁₉H₂₂N₈O₃
Molecular Weight: 410.43000
Create Date: 2017-09-03 15:33:08
Modify Date: 2024-04-02 17:52:29

Name	2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butanoic acid
Synonyms	Butanoic acid,2-((4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)amino)-,(+-) Butyric acid,2-(p-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzamido)-,(+-) DL-2-(p-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)benzamido)butyric acid

Molecular Formula	C₁₉H₂₂N₈O₃
Molecular Weight	410.43000
Exact Mass	410.18100
PSA	173.97000
LogP	1.71580

CHEMICAL IDENTIFICATION

RTECS NUMBER :: ES8980000

CHEMICAL NAME :: Butyric acid, 2-(p-(((2,4-diamino-6-pteridinyl)methyl)methylamino)b enzamido)-, (+-)-

CAS REGISTRY NUMBER :: 68352-95-4

LAST UPDATED :: 199610

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C19-H22-N8-O3

MOLECULAR WEIGHT :: 410.49

WISWESSER LINE NOTATION :: T66 BN DN GN JNJ CZ EZ H1N1&R DVMY2&VQ -DL

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Unreported

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 924 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NEOLA4 Neoplasma. (Karger-Libri, P.O. Box, CH-4009 Basel, Switzerland) V.4- 1957- Volume(issue)/page/year: 29,43,1982