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Substance Name: 2H-Benzimidazol-2-one, 1,3-dihydro-1-(1-(2-(3,4-dihydroxyphenyl)-2-hydroxyethyl)-4-piperidinyl)-3-methyl-
RN: 74406-07-8
InChIKey: WVYBDKXHXCYNPF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N3-O4

Molecular Weight

  • 383.4455
 
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Names and Synonyms

Synonym

  • ((Dihydroxy-3,4 phenyl)-2 hydroxy-2) ethyl-1 (methyl-3 oxo-2 benzimidazolinyl-1)-4 piperidine

Systematic Name

  • 2H-Benzimidazol-2-one, 1,3-dihydro-1-(1-(2-(3,4-dihydroxyphenyl)-2-hydroxyethyl)-4-piperidinyl)-3-methyl-

Registry Numbers

CAS Registry Number

  • 74406-07-8

System Generated Number

  • 0074406078

Structure Descriptors

InChI

1S/C21H25N3O4/c1-22-16-4-2-3-5-17(16)24(21(22)28)15-8-10-23(11-9-15)13-20(27)14-6-7-18(25)19(26)12-14/h2-7,12,15,20,25-27H,8-11,13H2,1H3

InChIKey

WVYBDKXHXCYNPF-UHFFFAOYSA-N

Smiles

CN1C(=O)N(C2CCN(CC(O)c3ccc(O)c(O)c3)CC2)c4ccccc14

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 200mg/kg (200mg/kg)   European Patent Application. Vol. #0008259,
mouse LD50 oral > 1600mg/kg (1600mg/kg)   European Patent Application. Vol. #0008259,