5-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0725 |
| Compound Name: | 5-{[2-(butylamino)-2-oxoethyl]sulfanyl}-N-(4-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 368.45 |
| Molecular Formula: | C15 H17 F N4 O2 S2 |
| Smiles: | CCCCNC(CSc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8372 |
| logD: | 2.8364 |
| logSw: | -3.3749 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.508 |
| InChI Key: | OTWUIHXHDFDPMA-UHFFFAOYSA-N |