N-[2-(diethylamino)ethyl]-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[2-(diethylamino)ethyl]-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[2-(diethylamino)ethyl]-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0324 |
| Compound Name: | N-[2-(diethylamino)ethyl]-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 540.6 |
| Molecular Formula: | C20 H34 N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCN(CC)CCN(CCC(N1CCNCC1)=O)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7972 |
| logD: | -0.0307 |
| logSw: | -2.383 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.879 |
| InChI Key: | TXLRCQRBHSZASI-UHFFFAOYSA-N |