N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentyl-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentyl-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentyl-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0385 |
| Compound Name: | N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-pentyl-4-(propan-2-yl)benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 509.59 |
| Molecular Formula: | C20 H33 N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCCCN(CC(N1CCNCC1)=O)S(c1ccc(cc1)C(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1685 |
| logD: | 2.609 |
| logSw: | -3.3017 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.945 |
| InChI Key: | SFFXTOPROXZUSC-UHFFFAOYSA-N |