5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0365 |
| Compound Name: | 5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 545.96 |
| Molecular Formula: | C18 H26 Cl N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1S(N(CC1CCCO1)CC(N1CCNCC1)=O)(=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2853 |
| logD: | -0.2742 |
| logSw: | -2.7572 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.98 |
| InChI Key: | ONPPVQJLWYADBJ-OAHLLOKOSA-N |