3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-7-methoxy-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-7-methoxy-2H-1-benzopyran-2-imine
3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-7-methoxy-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0321 |
| Compound Name: | 3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-7-methoxy-2H-1-benzopyran-2-imine |
| Molecular Weight: | 435.45 |
| Molecular Formula: | C23 H17 N O6 S |
| Smiles: | COc1ccc2C=C(/C(=N/c3ccc4c(c3)OCO4)Oc2c1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.383 |
| logD: | 4.3829 |
| logSw: | -4.47 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.105 |
| InChI Key: | APLGECBMEFVCPQ-UHFFFAOYSA-N |