5-[(N-cyclopropyl-2-methylpropanamido)methyl]-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
5-[(N-cyclopropyl-2-methylpropanamido)methyl]-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
5-[(N-cyclopropyl-2-methylpropanamido)methyl]-2-methoxyphenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V031-2100 |
| Compound Name: | 5-[(N-cyclopropyl-2-methylpropanamido)methyl]-2-methoxyphenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 433.52 |
| Molecular Formula: | C22 H27 N O6 S |
| Smiles: | CC(C)C(N(Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6172 |
| logD: | 3.6172 |
| logSw: | -3.8525 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.048 |
| InChI Key: | LUYMZLORJRAWMX-UHFFFAOYSA-N |