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Substance Name: 1H-Pyrazole-4-acetic acid, 1-methyl-5-(2-methyl-4-oxo-3(4H)-quinazolinyl)-, ethyl ester
RN: 160662-10-2
InChIKey: XZIATLQDPNXYAO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H18-N4-O3

Molecular Weight

  • 326.3542
 
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Names and Synonyms

Synonym

  • Ethyl 1-methyl-5-(2-methyl-4-oxo-3(4H)-quinazolinyl)-1H-pyrazole-4-acetate

Systematic Name

  • 1H-Pyrazole-4-acetic acid, 1-methyl-5-(2-methyl-4-oxo-3(4H)-quinazolinyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 160662-10-2

System Generated Number

  • 0160662102

Structure Descriptors

InChI

1S/C17H18N4O3/c1-4-24-15(22)9-12-10-18-20(3)16(12)21-11(2)19-14-8-6-5-7-13(14)17(21)23/h5-8,10H,4,9H2,1-3H3

InChIKey

XZIATLQDPNXYAO-UHFFFAOYSA-N

Smiles

CCOC(=O)Cc1cnn(c1n2c(nc3ccccc3c2=O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 750mg/kg (750mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 29, Pg. 707, 1994.
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 29, Pg. 707, 1994.