2,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
2,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0657 |
| Compound Name: | 2,5-dimethoxy-N-[(3-methoxyphenyl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 591.6 |
| Molecular Formula: | C23 H31 N3 O6 S |
| Salt: | CF3COOH |
| Smiles: | COc1cccc(CN(CCC(N2CCNCC2)=O)S(c2cc(ccc2OC)OC)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 1.4928 |
| logD: | 0.6648 |
| logSw: | -2.517 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.392 |
| InChI Key: | LXOAOQOYASLUJU-UHFFFAOYSA-N |