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Substance Name: (2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(dimethylamino)phenyl)ethyl methyl ester
RN: 116308-66-8
InChIKey: YNLYZVSPMOTLTN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H28-N4-O4

Molecular Weight

  • 460.5312
 
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Names and Synonyms

  • (2,4'-Bipyridine)-3',5'-dicarboxylic acid, 1',4'-dihydro-4-cyano-2',6'-dimethyl-, 2-(4-(dimethylamino)phenyl)ethyl methyl ester

Registry Numbers

CAS Registry Number

  • 116308-66-8

System Generated Number

  • 0116308668

Structure Descriptors

InChI

1S/C26H28N4O4/c1-16-22(25(31)33-5)24(21-14-19(15-27)10-12-28-21)23(17(2)29-16)26(32)34-13-11-18-6-8-20(9-7-18)30(3)4/h6-10,12,14,24,29H,11,13H2,1-5H3

InChIKey

YNLYZVSPMOTLTN-UHFFFAOYSA-N

Smiles

CC1=C(C(C(=C(N1)C)C(=O)OCCc2ccc(cc2)N(C)C)c3cc(ccn3)C#N)C(=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported > 1100mg/kg (1100mg/kg)   United States Patent Document. Vol. #4886819,