3,4-dimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3,4-dimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
3,4-dimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-1019 |
| Compound Name: | 3,4-dimethoxy-N-(2-methylpropyl)-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 527.56 |
| Molecular Formula: | C19 H31 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)CN(CCC(N1CCNCC1)=O)S(c1ccc(c(c1)OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9447 |
| logD: | 0.1168 |
| logSw: | -2.4812 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.206 |
| InChI Key: | HQVSRTUZYTXRON-UHFFFAOYSA-N |