N-[2-(diethylamino)ethyl]-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(diethylamino)ethyl]-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[2-(diethylamino)ethyl]-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0344 |
| Compound Name: | N-[2-(diethylamino)ethyl]-4-ethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 538.63 |
| Molecular Formula: | C21 H36 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(cc1)S(N(CCC(N1CCNCC1)=O)CCN(CC)CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7455 |
| logD: | 0.9175 |
| logSw: | -2.508 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.335 |
| InChI Key: | URDRGOSQEQINDX-UHFFFAOYSA-N |