5-chloro-N-cycloheptyl-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-chloro-N-cycloheptyl-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
5-chloro-N-cycloheptyl-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0144 |
| Compound Name: | 5-chloro-N-cycloheptyl-2-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 558.02 |
| Molecular Formula: | C20 H30 Cl N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1S(N(CC(N1CCNCC1)=O)C1CCCCCC1)(=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.4765 |
| logD: | 1.917 |
| logSw: | -3.4381 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.94 |
| InChI Key: | WYAPUDAQKGLUGH-UHFFFAOYSA-N |