(16E)-16-[(1-methyl-1H-pyrazol-5-yl)methylidene]estra-1(10),2,4-triene-3,17-diol
Chemical Structure Depiction of
(16E)-16-[(1-methyl-1H-pyrazol-5-yl)methylidene]estra-1(10),2,4-triene-3,17-diol
(16E)-16-[(1-methyl-1H-pyrazol-5-yl)methylidene]estra-1(10),2,4-triene-3,17-diol
Compound characteristics
| Compound ID: | Y505-7185 |
| Compound Name: | (16E)-16-[(1-methyl-1H-pyrazol-5-yl)methylidene]estra-1(10),2,4-triene-3,17-diol |
| Molecular Weight: | 364.49 |
| Molecular Formula: | C23 H28 N2 O2 |
| Smiles: | CC12CCC3C(CCc4cc(ccc34)O)C1C/C(=C\c1ccnn1C)C2O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4014 |
| logD: | 3.4011 |
| logSw: | -4.1611 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.352 |
| InChI Key: | IHDFXAYYAHEPNS-UHFFFAOYSA-N |