N-cyclohexyl-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclohexyl-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-cyclohexyl-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0815 |
| Compound Name: | N-cyclohexyl-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 521.6 |
| Molecular Formula: | C21 H33 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(cc1)S(N(CCC(N1CCNCC1)=O)C1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7791 |
| logD: | 1.9512 |
| logSw: | -3.2226 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.957 |
| InChI Key: | JETMIUYSOUHPOF-UHFFFAOYSA-N |