2-fluoro-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-fluoro-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
2-fluoro-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0856 |
| Compound Name: | 2-fluoro-N-[2-(2-methylpiperidin-1-yl)ethyl]-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 554.6 |
| Molecular Formula: | C21 H33 F N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC1CCCCN1CCN(CCS(N1CCNCC1)(=O)=O)C(c1ccccc1F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.7772 |
| logD: | -0.0214 |
| logSw: | -2.3769 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.405 |
| InChI Key: | WBCMUAINCWLZQX-SFHVURJKSA-N |