N-(2H-1,3-benzodioxol-5-yl)-3-(2,1,3-benzothiadiazole-4-sulfonyl)propanamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-3-(2,1,3-benzothiadiazole-4-sulfonyl)propanamide
N-(2H-1,3-benzodioxol-5-yl)-3-(2,1,3-benzothiadiazole-4-sulfonyl)propanamide
Compound characteristics
| Compound ID: | C105-0849 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-3-(2,1,3-benzothiadiazole-4-sulfonyl)propanamide |
| Molecular Weight: | 391.42 |
| Molecular Formula: | C16 H13 N3 O5 S2 |
| Smiles: | C(CS(c1cccc2c1nsn2)(=O)=O)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2944 |
| logD: | 2.294 |
| logSw: | -3.0594 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.221 |
| InChI Key: | GYCNRHJDJNHEFS-UHFFFAOYSA-N |