4-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Chemical Structure Depiction of
4-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
4-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-3994 |
| Compound Name: | 4-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenyl 2-chloro-6-methylbenzene-1-sulfonate |
| Molecular Weight: | 425.93 |
| Molecular Formula: | C20 H24 Cl N O5 S |
| Smiles: | CC(C)N(Cc1ccc(cc1)OS(c1c(C)cccc1[Cl])(=O)=O)C(COC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3638 |
| logD: | 3.3638 |
| logSw: | -3.442 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.123 |
| InChI Key: | GFUPZVOOWSATTQ-UHFFFAOYSA-N |