N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | Y031-3334 |
| Compound Name: | N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-fluorobenzamide |
| Molecular Weight: | 359.44 |
| Molecular Formula: | C17 H14 F N3 O S2 |
| Smiles: | C(c1ccccc1)SCc1nnc(NC(c2cccc(c2)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3374 |
| logD: | 2.7549 |
| logSw: | -4.3983 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.098 |
| InChI Key: | LGLAWICSUJTVTG-UHFFFAOYSA-N |