Methotrexate di-n-butyl ester

Names

[ Name ]:
Methotrexate di-n-butyl ester

[Synonym ]:
Dbmtx
dibutyl n-(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}benzoyl)glutamate
Glutamic acid,N-(p-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-,dibutyl ester,L-(+)
Dibutyl methotrexate
2-{4-[(2,4-diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoyl}-glutamic acid dibutyl ester
Methotrexate di-n-butyl ester

Chemical & Physical Properties

[ Density]:
1.272g/cm3

[ Molecular Formula ]:
C₂₈H₃₈N₈O₅

[ Molecular Weight ]:
566.65200

[ Exact Mass ]:
566.29700

[ PSA ]:
188.54000

[ LogP ]:
4.33910

[ Index of Refraction ]:
1.619

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: MA1230000

CHEMICAL NAME :: Glutamic acid, N-(p-(((2,4-diamino-6-pteridinyl)methyl)methylamino)b enzoyl)-, dibutyl ester, L-(+)-

CAS REGISTRY NUMBER :: 50602-77-2

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C28-H38-N8-O5

MOLECULAR WEIGHT :: 566.74

WISWESSER LINE NOTATION :: T66 BN DN GN JNJ CZ EZ H1N1&R DVMYVO4&2VO4

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :: DNA inhibition

TEST SYSTEM :: Rodent - mouse Leukocyte

DOSE/DURATION :: 1 umol/L

REFERENCE :: BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 25,1943,1976