N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1)
N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0331 |
| Compound Name: | N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 501.52 |
| Molecular Formula: | C20 H25 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | C(CN(CC(N1CCNCC1)=O)S(c1ccccc1)(=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.4731 |
| logD: | 0.9136 |
| logSw: | -2.3766 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.674 |
| InChI Key: | DBTLXDIBAKSBNZ-UHFFFAOYSA-N |