5-{[N-(butan-2-yl)-2,4-dimethoxybenzamido]methyl}-2-methoxyphenyl methanesulfonate
Chemical Structure Depiction of
5-{[N-(butan-2-yl)-2,4-dimethoxybenzamido]methyl}-2-methoxyphenyl methanesulfonate
5-{[N-(butan-2-yl)-2,4-dimethoxybenzamido]methyl}-2-methoxyphenyl methanesulfonate
Compound characteristics
| Compound ID: | V011-5951 |
| Compound Name: | 5-{[N-(butan-2-yl)-2,4-dimethoxybenzamido]methyl}-2-methoxyphenyl methanesulfonate |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C22 H29 N O7 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(C)(=O)=O)OC)C(c1ccc(cc1OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1839 |
| logD: | 3.1839 |
| logSw: | -3.5108 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.818 |
| InChI Key: | NNHRALGBBIOMMB-HNNXBMFYSA-N |