5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V011-7754 |
| Compound Name: | 5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 477.62 |
| Molecular Formula: | C25 H35 N O6 S |
| Smiles: | CC(C)CN(Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0876 |
| logD: | 5.0876 |
| logSw: | -4.9928 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.216 |
| InChI Key: | STYNQPVZQHMWCH-UHFFFAOYSA-N |