N-(5-{2-[(4-bromophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-4-fluorobenzamide
Chemical Structure Depiction of
N-(5-{2-[(4-bromophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-4-fluorobenzamide
N-(5-{2-[(4-bromophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-4-fluorobenzamide
Compound characteristics
| Compound ID: | 8009-7351 |
| Compound Name: | N-(5-{2-[(4-bromophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-yl)-4-fluorobenzamide |
| Molecular Weight: | 438.34 |
| Molecular Formula: | C17 H13 Br F N3 O S2 |
| Smiles: | C(CSc1ccc(cc1)[Br])c1nnc(NC(c2ccc(cc2)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.367 |
| logD: | 3.7646 |
| logSw: | -5.7535 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.098 |
| InChI Key: | MDVADSPIAMPNJM-UHFFFAOYSA-N |