(16E)-17-oxo-16-[(5-phenylthiophen-2-yl)methylidene]androst-5-en-3-yl acetate
Chemical Structure Depiction of
(16E)-17-oxo-16-[(5-phenylthiophen-2-yl)methylidene]androst-5-en-3-yl acetate
(16E)-17-oxo-16-[(5-phenylthiophen-2-yl)methylidene]androst-5-en-3-yl acetate
Compound characteristics
| Compound ID: | Y505-3288 |
| Compound Name: | (16E)-17-oxo-16-[(5-phenylthiophen-2-yl)methylidene]androst-5-en-3-yl acetate |
| Molecular Weight: | 500.7 |
| Molecular Formula: | C32 H36 O3 S |
| Smiles: | CC(=O)OC1CCC2(C)C3CCC4(C)C(C/C(=C\c5ccc(c6ccccc6)s5)C4=O)C3CC=C2C1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.4032 |
| logD: | 7.4032 |
| logSw: | -5.8305 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.445 |
| InChI Key: | WVBTTXJDRTYAGU-UHFFFAOYSA-N |