(16E)-16-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-3-hydroxyestra-1(10),2,4-trien-17-one
Chemical Structure Depiction of
(16E)-16-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-3-hydroxyestra-1(10),2,4-trien-17-one
(16E)-16-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-3-hydroxyestra-1(10),2,4-trien-17-one
Compound characteristics
| Compound ID: | Y505-7173 |
| Compound Name: | (16E)-16-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-3-hydroxyestra-1(10),2,4-trien-17-one |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C24 H28 N2 O2 |
| Smiles: | CCn1cc(\C=C2/CC3C4CCc5cc(ccc5C4CCC3(C)C2=O)O)cn1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9358 |
| logD: | 3.9356 |
| logSw: | -4.5056 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.36 |
| InChI Key: | OXIQPAHQNCLVTM-UHFFFAOYSA-N |