4-(2-methylpropyl)-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-(2-methylpropyl)-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-(2-methylpropyl)-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0703 |
| Compound Name: | 4-(2-methylpropyl)-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-[3-(piperidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 578.69 |
| Molecular Formula: | C24 H40 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)Cc1ccc(cc1)S(N(CCCN1CCCCC1)CC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4859 |
| logD: | 0.7938 |
| logSw: | -2.795 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.656 |
| InChI Key: | YSKXQIJHVDKNRC-UHFFFAOYSA-N |