N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1)
N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0467 |
| Compound Name: | N-[3-oxo-3-(piperazin-1-yl)propyl]-N-(2-phenylethyl)benzenesulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 515.55 |
| Molecular Formula: | C21 H27 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | C(CN(CCc1ccccc1)S(c1ccccc1)(=O)=O)C(N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6766 |
| logD: | 0.8486 |
| logSw: | -2.3275 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.652 |
| InChI Key: | PKOGVIVERWQGRH-UHFFFAOYSA-N |