Ospemifene
2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]ethanol
Molecular Identity
Ospemifene
2-[4-[(Z)-4-chloro-1,2-diphenylbut-1-enyl]phenoxy]ethanol
PubChem CID: 3036505
Ospemifene is an organochlorine compound that is a selective estrogen receptor modulator; used for treatment of dyspareunia. It has a role as an antineoplastic agent, an estrogen receptor modulator and an anti-inflammatory agent. It is a primary alcohol, an aromatic ether and an organochlorine compound. It derives from a hydride of a stilbene.
2D Structure
Properties
C24H23ClO2
Molecular Formula
378.90
Molecular Weight
g/mol
378.1387
Exact Mass
Da
6.5
XLogP
Above Lipinski threshold
29.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
2
H-Bond Acceptors
441
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=C(C=C3)OCCO)CCClIsomeric SMILES
SMILES: C1=CC=C(C=C1)/C(=C(/C2=CC=CC=C2)\C3=CC=C(C=C3)OCCO)/CCClSynonyms(20)
Ospemifene128607-22-7OsphenaFC-1271asenshioDeamino-hydroxytoremifeneFc-1271Tore iii2-(4-(4-chloro-1,2-diphenyl-but-1-enyl)phenoxy)ethanol2-(p-((Z)-4-Chloro-1,2-diphenyl-1-butenyl)phenoxy)ethanolOspemifeno(deaminohydroxy) toremifeneB0P231ILBKCHEBI:73275DTXSID101025426
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Ospemifene
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