5-{4-oxo-4-[4-(pyridin-2-yl)piperazin-1-yl]butyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{4-oxo-4-[4-(pyridin-2-yl)piperazin-1-yl]butyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-{4-oxo-4-[4-(pyridin-2-yl)piperazin-1-yl]butyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0665 |
| Compound Name: | 5-{4-oxo-4-[4-(pyridin-2-yl)piperazin-1-yl]butyl}-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C22 H24 N6 O2 S |
| Smiles: | C(CC(N1CCN(CC1)c1ccccn1)=O)Cc1nnc(C(Nc2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.6463 |
| logD: | 2.6374 |
| logSw: | -3.1917 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.221 |
| InChI Key: | JVPKDZMJBUYXTL-UHFFFAOYSA-N |