1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[2-(4-benzylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[2-(4-benzylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[2-(4-benzylpiperazin-1-yl)ethyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K906-0811 |
| Compound Name: | 1-(2,1,3-benzoxadiazole-4-sulfonyl)-N-[2-(4-benzylpiperazin-1-yl)ethyl]piperidine-4-carboxamide |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C25 H32 N6 O4 S |
| Smiles: | C1CN(CCC1C(NCCN1CCN(CC1)Cc1ccccc1)=O)S(c1cccc2c1non2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1022 |
| logD: | 1.85 |
| logSw: | -2.615 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.817 |
| InChI Key: | POYZQOHXORYTOA-UHFFFAOYSA-N |