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Substance Name: 1-Piperazineethanol, alpha-((4-(7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl)phenoxy)methyl)-4-phenyl-
RN: 111038-44-9
InChIKey: YCKODJGOTHLQFP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C37-H40-N2-O4

Molecular Weight

  • 576.733
 
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Names and Synonyms

  • 1-Piperazineethanol, alpha-((4-(7-methoxy-2,2-dimethyl-3-phenyl-2H-1-benzopyran-4-yl)phenoxy)methyl)-4-phenyl-

Registry Numbers

CAS Registry Number

  • 111038-44-9

System Generated Number

  • 0111038449

Structure Descriptors

InChI

1S/C37H40N2O4/c1-37(2)36(28-10-6-4-7-11-28)35(33-19-18-32(41-3)24-34(33)43-37)27-14-16-31(17-15-27)42-26-30(40)25-38-20-22-39(23-21-38)29-12-8-5-9-13-29/h4-19,24,30,40H,20-23,25-26H2,1-3H3

InChIKey

YCKODJGOTHLQFP-UHFFFAOYSA-N

Smiles

CC1(C(=C(c2ccc(cc2O1)OC)c3ccc(cc3)OCC(CN4CCN(CC4)c5ccccc5)O)c6ccccc6)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 825mg/kg (825mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 49, Pg. 43, 1987.