propan-2-yl 2-[(3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenoxy)sulfonyl]benzoate
Chemical Structure Depiction of
propan-2-yl 2-[(3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenoxy)sulfonyl]benzoate
propan-2-yl 2-[(3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenoxy)sulfonyl]benzoate
Compound characteristics
| Compound ID: | V031-1924 |
| Compound Name: | propan-2-yl 2-[(3-{[(methoxyacetyl)(propan-2-yl)amino]methyl}phenoxy)sulfonyl]benzoate |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C23 H29 N O7 S |
| Smiles: | CC(C)N(Cc1cccc(c1)OS(c1ccccc1C(=O)OC(C)C)(=O)=O)C(COC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1646 |
| logD: | 3.1646 |
| logSw: | -3.5855 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 80.555 |
| InChI Key: | MBCYKYHHBXVHPK-UHFFFAOYSA-N |