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Substance Name: Pyridine, 1,2,3,6-tetrahydro-4-(4-chlorophenyl)-1-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-
RN: 71916-44-4
InChIKey: VLNZHMSMASUUKG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H21-Cl-F3-N3-O

Molecular Weight

  • 507.9409
 
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Names and Synonyms

Synonym

  • BRN 0466671

Systematic Name

  • Pyridine, 1,2,3,6-tetrahydro-4-(4-chlorophenyl)-1-(4-((7-(trifluoromethyl)-4-quinolinyl)amino)benzoyl)-

Registry Numbers

CAS Registry Number

  • 71916-44-4

System Generated Number

  • 0071916444

Structure Descriptors

InChI

1S/C28H21ClF3N3O/c29-22-6-1-18(2-7-22)19-12-15-35(16-13-19)27(36)20-3-8-23(9-4-20)34-25-11-14-33-26-17-21(28(30,31)32)5-10-24(25)26/h1-12,14,17H,13,15-16H2,(H,33,34)

InChIKey

VLNZHMSMASUUKG-UHFFFAOYSA-N

Smiles

c1cc(ccc1C2=CCN(CC2)C(=O)c3ccc(cc3)Nc4ccnc5c4ccc(c5)C(F)(F)F)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg) VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION Journal of Medicinal Chemistry. Vol. 29, Pg. 133, 1986.