({4-methoxy-3-[(thiomorpholin-4-yl)methyl]phenyl}methylidene)propanedinitrile
Chemical Structure Depiction of
({4-methoxy-3-[(thiomorpholin-4-yl)methyl]phenyl}methylidene)propanedinitrile
({4-methoxy-3-[(thiomorpholin-4-yl)methyl]phenyl}methylidene)propanedinitrile
Compound characteristics
| Compound ID: | Y502-4474 |
| Compound Name: | ({4-methoxy-3-[(thiomorpholin-4-yl)methyl]phenyl}methylidene)propanedinitrile |
| Molecular Weight: | 299.39 |
| Molecular Formula: | C16 H17 N3 O S |
| Smiles: | COc1ccc(C=C(C#N)C#N)cc1CN1CCSCC1 |
| Stereo: | ACHIRAL |
| logP: | 2.4169 |
| logD: | 2.3417 |
| logSw: | -2.6354 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.714 |
| InChI Key: | LIYWXBAVDONVDB-UHFFFAOYSA-N |