4-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
4-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0796 |
| Compound Name: | 4-methyl-N-[2-(piperazine-1-sulfonyl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 550.64 |
| Molecular Formula: | C22 H36 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1)C(N(CCCN1CCCCC1)CCS(N1CCNCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1204 |
| logD: | -1.144 |
| logSw: | -2.1428 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.955 |
| InChI Key: | ZZMKMCUVBYOBCT-UHFFFAOYSA-N |