N-cyclohexyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclohexyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-cyclohexyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0803 |
| Compound Name: | N-cyclohexyl-2,5-dimethoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 553.6 |
| Molecular Formula: | C21 H33 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(c(c1)S(N(CCC(N1CCNCC1)=O)C1CCCCC1)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.701 |
| logD: | 0.873 |
| logSw: | -2.47 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.131 |
| InChI Key: | NUQYBSVYVZWTNZ-UHFFFAOYSA-N |