N-(4-chlorophenyl)-5-{[2-(4-fluoro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-{[2-(4-fluoro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-{[2-(4-fluoro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0515 |
| Compound Name: | N-(4-chlorophenyl)-5-{[2-(4-fluoro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 436.91 |
| Molecular Formula: | C18 H14 Cl F N4 O2 S2 |
| Smiles: | Cc1cc(ccc1NC(CSc1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O)F |
| Stereo: | ACHIRAL |
| logP: | 4.0868 |
| logD: | 4.086 |
| logSw: | -4.4554 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.375 |
| InChI Key: | PYUOJBLMXKKRJB-UHFFFAOYSA-N |