3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-0602 |
| Compound Name: | 3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 407.48 |
| Molecular Formula: | C20 H25 N O6 S |
| Smiles: | CC(C)N(Cc1cccc(c1)OS(c1ccc(cc1)OC)(=O)=O)C(COC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8121 |
| logD: | 2.8121 |
| logSw: | -3.4778 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.666 |
| InChI Key: | BNTBEXUUIWEMLX-UHFFFAOYSA-N |