N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Chemical Structure Depiction of
N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V009-9809 |
| Compound Name: | N-(5-{[(2,4-difluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide |
| Molecular Weight: | 329.39 |
| Molecular Formula: | C13 H13 F2 N3 O S2 |
| Salt: | not_available |
| Smiles: | CC(C)C(Nc1nnc(SCc2ccc(cc2F)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2347 |
| logD: | 4.232 |
| logSw: | -4.1668 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.236 |
| InChI Key: | JPMFVWKQUGZZTA-UHFFFAOYSA-N |