N-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine
N-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0384 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C25 H21 N O6 S |
| Smiles: | Cc1ccc(cc1C)S(C1=Cc2ccc(cc2OC/1=N/c1ccc2c(c1)OCO2)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4571 |
| logD: | 5.4571 |
| logSw: | -5.5499 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.105 |
| InChI Key: | INHYHXNSIXGNDS-UHFFFAOYSA-N |