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Substance Name: Androst-4-en-3-one, 17-alpha-hydroxy-17-beta-(2-(isopropylamino)-4-thiazolyl)-
RN: 95872-06-3
InChIKey: CFMGDMFPQAVEBN-MWGRHRFLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H36-N2-O2-S

Molecular Weight

  • 428.637
 
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Names and Synonyms

Synonym

  • 17-alpha-Hydroxy-17-beta-(2-(isopropylamino)-4-thiazolyl)androst-4-en-3-one

Systematic Names

  • Androst-4-en-3-one, 17-alpha-hydroxy-17-beta-(2-(isopropylamino)-4-thiazolyl)-
  • Androst-4-en-3-one, 17alpha-hydroxy-17-(2-(isopropylamino)-4-thiazolyl)-

Registry Numbers

CAS Registry Number

  • 95872-06-3

System Generated Number

  • 0095872063

Structure Descriptors

InChI

1S/C25H36N2O2S/c1-15(2)26-22-27-21(14-30-22)25(29)12-9-20-18-6-5-16-13-17(28)7-10-23(16,3)19(18)8-11-24(20,25)4/h13-15,18-20,29H,5-12H2,1-4H3,(H,26,27)/t18-,19+,20+,23+,24+,25+/m1/s1

InChIKey

CFMGDMFPQAVEBN-MWGRHRFLSA-N

Smiles

C1[C@@]2([C@H]([C@H]3[C@H]([C@@]4(C(=CC(=O)CC4)CC3)C)C1)CC[C@@]2(c1nc(NC(C)C)sc1)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
frog LDLo parenteral 30mg/kg (30mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 11, Pg. 604, 1963.
pigeon LDLo parenteral 5330ug/kg (5.33mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 11, Pg. 604, 1963.