2-(1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enenitrile
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enenitrile
2-(1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-1152 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-3-(4-propoxyphenyl)prop-2-enenitrile |
| Molecular Weight: | 320.41 |
| Molecular Formula: | C19 H16 N2 O S |
| Smiles: | CCCOc1ccc(\C=C(/C#N)c2nc3ccccc3s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5067 |
| logD: | 5.5067 |
| logSw: | -5.608 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 34.161 |
| InChI Key: | GNVYRVXUYKHUCT-UHFFFAOYSA-N |