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65213-48-1

65213-48-1 structural image
Product Name: (Z)-4-HYDROXYTAMOXIFEN
Formula: C26H29NO2
Synonyms: (Z)-4-(1-[4-(Dimethylaminoethoxy)phenyl]-2-phenyl-1-butenyl)phenol;(Z)-4-OHT;trans-4-Hydroxytamoxifen
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COMPUTED DESCRIPTORS

Molecular Weight 387.5 g/mol
XLogP3 6.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 8
Exact Mass 387.219829168 g/mol
Monoisotopic Mass 387.219829168 g/mol
Topological Polar Surface Area 32.7 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 493
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Afimoxifene is a tertiary amino compound that is tamoxifen in which the phenyl group which is in a Z- relationship to the ethyl substituent is hydroxylated at the para- position. It is the active metabolite of tamoxifen. It has a role as an antineoplastic agent, an estrogen receptor antagonist and a metabolite. It is a tertiary amino compound and a member of phenols. It is functionally related to a tamoxifen.