4-butoxy-N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Chemical Structure Depiction of
4-butoxy-N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
4-butoxy-N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | 3202-0058 |
| Compound Name: | 4-butoxy-N-(5-{[(2-fluorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)benzamide |
| Molecular Weight: | 417.52 |
| Molecular Formula: | C20 H20 F N3 O2 S2 |
| Smiles: | CCCCOc1ccc(cc1)C(Nc1nnc(SCc2ccccc2F)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2085 |
| logD: | 6.1855 |
| logSw: | -5.4787 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.382 |
| InChI Key: | BTQHYWXMDVKDJF-UHFFFAOYSA-N |