N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide
N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide
Compound characteristics
| Compound ID: | V012-3521 |
| Compound Name: | N-[5-(butylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-fluorobenzamide |
| Molecular Weight: | 311.4 |
| Molecular Formula: | C13 H14 F N3 O S2 |
| Salt: | not_available |
| Smiles: | CCCCSc1nnc(NC(c2cccc(c2)F)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5896 |
| logD: | 4.1798 |
| logSw: | -4.3585 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.236 |
| InChI Key: | CURAAVQLSMSTER-UHFFFAOYSA-N |