3-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
3-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-6608 |
| Compound Name: | 3-({N-[(oxolan-2-yl)methyl](propan-2-yl)carbamamido}methyl)phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 462.56 |
| Molecular Formula: | C23 H30 N2 O6 S |
| Smiles: | CC(C)NC(N(CC1CCCO1)Cc1cccc(c1)OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3595 |
| logD: | 3.3595 |
| logSw: | -3.8418 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.526 |
| InChI Key: | SHDRKULBKMKUCB-OAQYLSRUSA-N |