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Substance Name: Cyclobutanol, 1-(4-chlorophenyl)-3-(4-(2-pyridinyl)-1-piperazinyl)-2,2,4,4-tetramethyl-, cis-
RN: 53087-70-0
InChIKey: TUTXHLRCKAIZEV-JKIUYZKVSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H30-Cl-N3-O

Molecular Weight

  • 399.963
 
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Names and Synonyms

Synonyms

  • cis-1-(4-Chlorophenyl)-2,2,4,4-tetramethyl-3-(4-(pyridyl-2)-piperazinyl)cyclobutanol-(1)
  • cis-1-(4-Chlorophenyl)-3-(4-(2-pyridinyl)-1-piperazinyl)-2,2,4,4-tetramethylcyclobutanol

Systematic Name

  • Cyclobutanol, 1-(4-chlorophenyl)-3-(4-(2-pyridinyl)-1-piperazinyl)-2,2,4,4-tetramethyl-, cis-

Registry Numbers

CAS Registry Number

  • 53087-70-0

System Generated Number

  • 0053087700

Structure Descriptors

InChI

1S/C23H30ClN3O/c1-21(2)20(22(3,4)23(21,28)17-8-10-18(24)11-9-17)27-15-13-26(14-16-27)19-7-5-6-12-25-19/h5-12,20,28H,13-16H2,1-4H3/t20-,23-

InChIKey

TUTXHLRCKAIZEV-JKIUYZKVSA-N

Smiles

CC1([C@@](C([C@H]1N2CCN(CC2)c3ncccc3)(C)C)(O)c4ccc(cc4)Cl)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 442mg/kg (442mg/kg)   United States Patent Document. Vol. #3992536,