3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]propanamide
Chemical Structure Depiction of
3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]propanamide
3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]propanamide
Compound characteristics
| Compound ID: | K906-6139 |
| Compound Name: | 3-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,5-dimethoxyphenyl)methyl]propanamide |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C18 H19 N3 O5 S2 |
| Smiles: | COc1ccc(c(CNC(CCS(c2cccc3c2nsn3)(=O)=O)=O)c1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.3616 |
| logD: | 2.3616 |
| logSw: | -2.9177 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.602 |
| InChI Key: | GCPYPGCMOCXTEK-UHFFFAOYSA-N |