3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-6-chloro-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-6-chloro-2H-1-benzopyran-2-imine
3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-6-chloro-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0244 |
| Compound Name: | 3-(benzenesulfonyl)-N-(2H-1,3-benzodioxol-5-yl)-6-chloro-2H-1-benzopyran-2-imine |
| Molecular Weight: | 439.87 |
| Molecular Formula: | C22 H14 Cl N O5 S |
| Smiles: | C1Oc2ccc(cc2O1)/N=C1/C(=Cc2cc(ccc2O1)[Cl])S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8909 |
| logD: | 4.8908 |
| logSw: | -5.0345 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.561 |
| InChI Key: | HRURUQCXVGVURB-UHFFFAOYSA-N |