N-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Chemical Structure Depiction of
N-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
N-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V009-5898 |
| Compound Name: | N-(5-{[(4-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-methylpropanamide |
| Molecular Weight: | 311.4 |
| Molecular Formula: | C13 H14 F N3 O S2 |
| Salt: | not_available |
| Smiles: | CC(C)C(Nc1nnc(SCc2ccc(cc2)F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6601 |
| logD: | 3.6574 |
| logSw: | -3.7859 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.236 |
| InChI Key: | AECXKAALKZOVEC-UHFFFAOYSA-N |