4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzene-1-sulfonamide--trifluoroacetic acid (1/1)
4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0602 |
| Compound Name: | 4-methoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]-N-{3-[(propan-2-yl)oxy]propyl}benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 527.56 |
| Molecular Formula: | C19 H31 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)OCCCN(CC(N1CCNCC1)=O)S(c1ccc(cc1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5699 |
| logD: | 0.0104 |
| logSw: | -2.4118 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.69 |
| InChI Key: | NKUHJKIIWKQBTP-UHFFFAOYSA-N |