N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-ethylbenzamide
Chemical Structure Depiction of
N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-ethylbenzamide
N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-ethylbenzamide
Compound characteristics
| Compound ID: | V014-4575 |
| Compound Name: | N-(5-{[(4-bromo-2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4-ethylbenzamide |
| Molecular Weight: | 452.37 |
| Molecular Formula: | C18 H15 Br F N3 O S2 |
| Smiles: | CCc1ccc(cc1)C(Nc1nnc(SCc2ccc(cc2F)[Br])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.511 |
| logD: | 6.4548 |
| logSw: | -5.6516 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.964 |
| InChI Key: | GZODQVQPFHCFEE-UHFFFAOYSA-N |