3-methoxy-N-{5-[2-(naphthalene-2-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
3-methoxy-N-{5-[2-(naphthalene-2-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
3-methoxy-N-{5-[2-(naphthalene-2-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | 1937-0356 |
| Compound Name: | 3-methoxy-N-{5-[2-(naphthalene-2-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C22 H19 N3 O4 S2 |
| Smiles: | COc1cccc(c1)C(Nc1nnc(CCS(c2ccc3ccccc3c2)(=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1193 |
| logD: | 3.7956 |
| logSw: | -4.3502 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.407 |
| InChI Key: | JEDZNNCKVFTIAK-UHFFFAOYSA-N |