4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-3691 |
| Compound Name: | 4-{[N-(2-methoxyethyl)-3,3-dimethylbutanamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C23 H31 N O6 S |
| Smiles: | CC(C)(C)CC(N(CCOC)Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0875 |
| logD: | 4.0875 |
| logSw: | -4.1915 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.82 |
| InChI Key: | FXZLJAKKDPGFEU-UHFFFAOYSA-N |