Amcenestrant (SAR439859)
6-(2,4-dichlorophenyl)-5-[4-[1-(3-fluoropropyl)pyrrolidin-3-yl]oxyphenyl]-8,9-dihydro-7H-benzo[7]annulene-2-carboxylic acid
Molecular Identity
Amcenestrant (SAR439859)
6-(2,4-dichlorophenyl)-5-[4-[1-(3-fluoropropyl)pyrrolidin-3-yl]oxyphenyl]-8,9-dihydro-7H-benzo[7]annulene-2-carboxylic acid
PubChem CID: 137449472
2D Structure
Properties
C31H30Cl2FNO3
Molecular Formula
554.50
Molecular Weight
g/mol
553.1587
Exact Mass
Da
5.3
XLogP
Above Lipinski threshold
49.8
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
5
H-Bond Acceptors
832
Complexity
SMILES
Canonical SMILES
SMILES: C1CC2=C(C=CC(=C2)C(=O)O)C(=C(C1)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)OC5CCN(C5)CCCFIsomeric SMILES
SMILES: C1CC2=C(C=CC(=C2)C(=O)O)C(=C(C1)C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)OC5CCN(C5)CCCFSynonyms(5)
Amcenestrant (SAR439859)SCHEMBL20688086GTPL10566s9609compound 43d [PMID: 31721572]
Data from PubChem (NCBI)
This platform is for informational purposes only and does not constitute medical advice. Always consult a qualified healthcare professional.
Drug Network
Trials and conditions connected to Amcenestrant (SAR439859)
Loading drug network...