N-(4-chlorophenyl)-5-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F865-0856 |
| Compound Name: | N-(4-chlorophenyl)-5-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 491.01 |
| Molecular Formula: | C22 H27 Cl N6 O3 S |
| Smiles: | CN1CCN(CC1)C(CC1CCN(CC1)C(c1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0523 |
| logD: | 1.761 |
| logSw: | -2.9879 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.079 |
| InChI Key: | LBXYSJCKKPDBPQ-UHFFFAOYSA-N |