N-cyclohexyl-2,4,5-trimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cyclohexyl-2,4,5-trimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-cyclohexyl-2,4,5-trimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0824 |
| Compound Name: | N-cyclohexyl-2,4,5-trimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 535.63 |
| Molecular Formula: | C22 H35 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cc(C)c(cc1C)S(N(CCC(N1CCNCC1)=O)C1CCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2127 |
| logD: | 2.3847 |
| logSw: | -3.4593 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.957 |
| InChI Key: | BPLLHGORASSHKE-UHFFFAOYSA-N |