5-({[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-({[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F499-0733 |
| Compound Name: | 5-({[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]sulfanyl}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 459.63 |
| Molecular Formula: | C22 H29 N5 O2 S2 |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CSCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2162 |
| logD: | 3.107 |
| logSw: | -3.4381 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.543 |
| InChI Key: | GOHCQXYJCRMPGI-UHFFFAOYSA-N |