4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0500 |
| Compound Name: | 4-ethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 559.6 |
| Molecular Formula: | C23 H31 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCOc1ccc(cc1)S(N(CC(C)c1ccccc1)CC(N1CCNCC1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8101 |
| logD: | 2.2506 |
| logSw: | -3.3156 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.819 |
| InChI Key: | KMVOXDISJVKTRZ-IBGZPJMESA-N |