5-[4-(4-cyclohexylpiperazin-1-yl)-4-oxobutyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[4-(4-cyclohexylpiperazin-1-yl)-4-oxobutyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[4-(4-cyclohexylpiperazin-1-yl)-4-oxobutyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0627 |
| Compound Name: | 5-[4-(4-cyclohexylpiperazin-1-yl)-4-oxobutyl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C23 H31 N5 O2 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CCCc1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0005 |
| logD: | 2.7019 |
| logSw: | -3.4902 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.543 |
| InChI Key: | VMUCJOJRDXMKKX-UHFFFAOYSA-N |