(16Z)-16-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]androstan-17-one
Chemical Structure Depiction of
(16Z)-16-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]androstan-17-one
(16Z)-16-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]androstan-17-one
Compound characteristics
| Compound ID: | 6049-0043 |
| Compound Name: | (16Z)-16-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methylidene]androstan-17-one |
| Molecular Weight: | 394.6 |
| Molecular Formula: | C26 H38 N2 O |
| Smiles: | CCn1c(C)c(/C=C2/CC3C4CCC5CCCCC5(C)C4CCC3(C)C2=O)cn1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.555 |
| logD: | 5.555 |
| logSw: | -5.6635 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.3583 |
| InChI Key: | HLNMGFKCMXUKSU-UHFFFAOYSA-N |