N-(2-{[(2H-1,3-benzodioxol-5-yl)methylidene]amino}ethyl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methylidene]amino}ethyl)-4-methylbenzene-1-sulfonamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methylidene]amino}ethyl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8002-6202 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methylidene]amino}ethyl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 346.4 |
| Molecular Formula: | C17 H18 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(NCC/N=C/c1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4004 |
| logD: | 3.3832 |
| logSw: | -3.7132 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.729 |
| InChI Key: | HSBBMRSMTSZOJX-UHFFFAOYSA-N |