4-bromo-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Chemical Structure Depiction of
4-bromo-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
4-bromo-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | Y031-0365 |
| Compound Name: | 4-bromo-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide |
| Molecular Weight: | 374.28 |
| Molecular Formula: | C12 H12 Br N3 O2 S2 |
| Smiles: | COCCSc1nnc(NC(c2ccc(cc2)[Br])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.4826 |
| logD: | 3.0473 |
| logSw: | -3.7312 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.578 |
| InChI Key: | UGNYPMIQFQNIOG-UHFFFAOYSA-N |