5-{[(3,4-dimethoxybenzene-1-sulfonyl)amino]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(3,4-dimethoxybenzene-1-sulfonyl)amino]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(3,4-dimethoxybenzene-1-sulfonyl)amino]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L063-0039 |
| Compound Name: | 5-{[(3,4-dimethoxybenzene-1-sulfonyl)amino]methyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 452.48 |
| Molecular Formula: | C18 H17 F N4 O5 S2 |
| Smiles: | COc1ccc(cc1OC)S(NCc1nnc(C(Nc2ccc(cc2)F)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2419 |
| logD: | 2.1862 |
| logSw: | -3.1374 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.348 |
| InChI Key: | BSADMVLODRABQE-UHFFFAOYSA-N |