N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine
Compound characteristics
| Compound ID: | C585-0385 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3,4-dimethylbenzene-1-sulfonyl)-7-methoxy-2H-1-benzopyran-2-imine |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C26 H23 N O6 S |
| Smiles: | Cc1ccc(cc1C)S(C1=Cc2ccc(cc2OC/1=N/c1ccc2c(c1)OCCO2)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5966 |
| logD: | 4.5964 |
| logSw: | -4.6046 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.813 |
| InChI Key: | RTPMCYYCWHUQSW-UHFFFAOYSA-N |