2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0488 |
| Compound Name: | 2,5-dimethyl-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylpropyl)benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 543.6 |
| Molecular Formula: | C23 H31 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(CN(CC(N1CCNCC1)=O)S(c1cc(C)ccc1C)(=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2012 |
| logD: | 2.6417 |
| logSw: | -3.3541 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.695 |
| InChI Key: | AUTZJVBCYYMHCS-FQEVSTJZSA-N |