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Substance Name: 1,3,8-Triazaspiro(4,5)decan-4-one, 8-(4,4-bis(4-fluorophenyl)cyclohexyl)-1-(4-chlorophenyl)-
RN: 61271-39-4
InChIKey: PVADHCQRQHNITG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H32-Cl-F2-N3-O

Molecular Weight

  • 536.0628
 
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Names and Synonyms

Synonyms

  • 8-(4,4-Bis(4-fluorophenyl)cyclohexyl)-1-(4-chlorophenyl)-1,3,8-triazaspiro(4,5)decan-4-one
  • 8-(4,4-Bis(p-fluorophenyl)cyclohexyl)-1-(p-chlorophenyl)-1,3,8-triazaspiro(4,5)decan-4-one

Systematic Name

  • 1,3,8-Triazaspiro(4,5)decan-4-one, 8-(4,4-bis(4-fluorophenyl)cyclohexyl)-1-(4-chlorophenyl)-

Registry Numbers

CAS Registry Number

  • 61271-39-4

System Generated Number

  • 0061271394

Structure Descriptors

InChI

1S/C31H32ClF2N3O/c32-24-5-11-28(12-6-24)37-21-35-29(38)31(37)17-19-36(20-18-31)27-13-15-30(16-14-27,22-1-7-25(33)8-2-22)23-3-9-26(34)10-4-23/h1-12,27H,13-21H2,(H,35,38)

InChIKey

PVADHCQRQHNITG-UHFFFAOYSA-N

Smiles

c1cc(ccc1C2(CCC(CC2)N3CCC4(CC3)C(=O)NCN4c5ccc(cc5)Cl)c6ccc(cc6)F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 464mg/kg (464mg/kg)   United States Patent Document. Vol. #4076821,