N-(4-fluorophenyl)-5-({2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-5-({2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-fluorophenyl)-5-({2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0631 |
| Compound Name: | N-(4-fluorophenyl)-5-({2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 487.57 |
| Molecular Formula: | C22 H22 F N5 O3 S2 |
| Smiles: | COc1cccc(c1)N1CCN(CC1)C(CSc1nnc(C(Nc2ccc(cc2)F)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5083 |
| logD: | 3.5075 |
| logSw: | -3.8762 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.12 |
| InChI Key: | KDLHYAFSYQJFIJ-UHFFFAOYSA-N |