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Substance Name: Acetamide, N-(2-(3-nitro-4-(1-pyrrolidinyl)phenyl)-4-oxo-3(4H)-quinazolinyl)-2-(4-((2-phenyl-1,8-naphthyridin-3-yl)carbonyl)phenoxy)-
RN: 136603-29-7
InChIKey: KVRXKVPDKKZRFO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C41-H31-N7-O6

Molecular Weight

  • 717.7389
 
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Names and Synonyms

Synonym

  • BRN 4900228

Systematic Name

  • Acetamide, N-(2-(3-nitro-4-(1-pyrrolidinyl)phenyl)-4-oxo-3(4H)-quinazolinyl)-2-(4-((2-phenyl-1,8-naphthyridin-3-yl)carbonyl)phenoxy)-

Registry Numbers

CAS Registry Number

  • 136603-29-7

System Generated Number

  • 0136603297

Structure Descriptors

InChI

1S/C41H31N7O6/c49-36(25-54-30-17-14-27(15-18-30)38(50)32-23-28-11-8-20-42-39(28)44-37(32)26-9-2-1-3-10-26)45-47-40(43-33-13-5-4-12-31(33)41(47)51)29-16-19-34(35(24-29)48(52)53)46-21-6-7-22-46/h1-5,8-20,23-24H,6-7,21-22,25H2,(H,45,49)

InChIKey

KVRXKVPDKKZRFO-UHFFFAOYSA-N

Smiles

c1ccc(cc1)c2c(cc3cccnc3n2)C(=O)c4ccc(cc4)OCC(=O)Nn5c(=O)c6ccccc6nc5c7ccc(c(c7)[N+](=O)[O-])N8CCCC8

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Journal of the Indian Chemical Society. Vol. 68, Pg. 85, 1991.