4-tert-butyl-N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
4-tert-butyl-N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | 3180-0055 |
| Compound Name: | 4-tert-butyl-N-{5-[2-(4-methoxybenzene-1-sulfonyl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C22 H25 N3 O4 S2 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nnc(CCS(c2ccc(cc2)OC)(=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7788 |
| logD: | 3.9558 |
| logSw: | -4.4336 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.678 |
| InChI Key: | UFIYRURYTUDNPZ-UHFFFAOYSA-N |