N-(2H-1,3-benzodioxol-5-yl)-8-methoxy-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-8-methoxy-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine
N-(2H-1,3-benzodioxol-5-yl)-8-methoxy-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0194 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-8-methoxy-3-(4-methylbenzene-1-sulfonyl)-2H-1-benzopyran-2-imine |
| Molecular Weight: | 449.48 |
| Molecular Formula: | C24 H19 N O6 S |
| Smiles: | Cc1ccc(cc1)S(C1=Cc2cccc(c2OC/1=N/c1ccc2c(c1)OCO2)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7794 |
| logD: | 4.7791 |
| logSw: | -4.7268 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.876 |
| InChI Key: | XXRXZVJMOJPJTJ-UHFFFAOYSA-N |