N-[(4-ethylphenyl)methyl]-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(4-ethylphenyl)methyl]-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[(4-ethylphenyl)methyl]-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F916-0845 |
| Compound Name: | N-[(4-ethylphenyl)methyl]-3,4-dimethoxy-N-[2-oxo-2-(piperazin-1-yl)ethyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 575.6 |
| Molecular Formula: | C23 H31 N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCc1ccc(CN(CC(N2CCNCC2)=O)S(c2ccc(c(c2)OC)OC)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9679 |
| logD: | 1.4084 |
| logSw: | -2.9292 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.956 |
| InChI Key: | AJNXGZGPBZLMNI-UHFFFAOYSA-N |