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Substance Name: Cyclobutanol, 1-(4-(1-methylethyl)phenyl)-3-(4-phenyl-1-piperazinyl)-2,2,4,4-tetramethyl-, cis-
RN: 53087-67-5
InChIKey: LZQCINCEAFYFSJ-HNKWHGCMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H38-N2-O

Molecular Weight

  • 406.6102
 
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Names and Synonyms

Synonym

  • cis-1-(4-Isopropylphenyl)-2,2,4,4-tetramethyl-3-(4-phenylpiperazinyl)cyclobutanol-(1)

Systematic Name

  • Cyclobutanol, 1-(4-(1-methylethyl)phenyl)-3-(4-phenyl-1-piperazinyl)-2,2,4,4-tetramethyl-, cis-

Registry Numbers

CAS Registry Number

  • 53087-67-5

System Generated Number

  • 0053087675

Structure Descriptors

InChI

1S/C27H38N2O/c1-20(2)21-12-14-22(15-13-21)27(30)25(3,4)24(26(27,5)6)29-18-16-28(17-19-29)23-10-8-7-9-11-23/h7-15,20,24,30H,16-19H2,1-6H3/t24-,27-

InChIKey

LZQCINCEAFYFSJ-HNKWHGCMSA-N

Smiles

CC(c1ccc(cc1)[C@]2(C([C@H](C2(C)C)N3CCN(CC3)c4ccccc4)(C)C)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 800mg/kg (800mg/kg)   United States Patent Document. Vol. #3992536,