4-tert-butyl-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-tert-butyl-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
4-tert-butyl-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | Y031-0478 |
| Compound Name: | 4-tert-butyl-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 351.49 |
| Molecular Formula: | C16 H21 N3 O2 S2 |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nnc(SCCOC)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4432 |
| logD: | 4.3463 |
| logSw: | -4.2112 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.578 |
| InChI Key: | VYNWESNURIHNQL-UHFFFAOYSA-N |