(14xi)-3-[(pentafluorophenyl)methoxy]-8xi,9xi-estra-1(10),2,4-trien-17-one
Chemical Structure Depiction of
(14xi)-3-[(pentafluorophenyl)methoxy]-8xi,9xi-estra-1(10),2,4-trien-17-one
(14xi)-3-[(pentafluorophenyl)methoxy]-8xi,9xi-estra-1(10),2,4-trien-17-one
Compound characteristics
| Compound ID: | Y041-5295 |
| Compound Name: | (14xi)-3-[(pentafluorophenyl)methoxy]-8xi,9xi-estra-1(10),2,4-trien-17-one |
| Molecular Weight: | 450.45 |
| Molecular Formula: | C25 H23 F5 O2 |
| Smiles: | C[C@]12CCC3C(CCc4cc(ccc34)OCc3c(c(c(c(c3F)F)F)F)F)C1CCC2=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.0213 |
| logD: | 6.0213 |
| logSw: | -5.6048 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.8416 |
| InChI Key: | YICMAVKYWQMGFT-YMSAOOGBSA-N |