2-(1,3-benzothiazol-2-yl)-3-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}prop-2-enenitrile
Chemical Structure Depiction of
2-(1,3-benzothiazol-2-yl)-3-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}prop-2-enenitrile
2-(1,3-benzothiazol-2-yl)-3-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}prop-2-enenitrile
Compound characteristics
| Compound ID: | 8018-1217 |
| Compound Name: | 2-(1,3-benzothiazol-2-yl)-3-{3-ethoxy-4-[(prop-2-en-1-yl)oxy]phenyl}prop-2-enenitrile |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C21 H18 N2 O2 S |
| Smiles: | CCOc1cc(\C=C(/C#N)c2nc3ccccc3s2)ccc1OCC=C |
| Stereo: | ACHIRAL |
| logP: | 5.0757 |
| logD: | 5.0757 |
| logSw: | -4.9176 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.458 |
| InChI Key: | LZBSWTMRIICQDY-UHFFFAOYSA-N |