methyl 2-(2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate
methyl 2-(2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate
Compound characteristics
| Compound ID: | C528-0331 |
| Compound Name: | methyl 2-(2-{[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C22 H22 N2 O6 S |
| Smiles: | Cc1ccc(cc1)c1nc(CS(CC(Nc2ccccc2C(=O)OC)=O)(=O)=O)c(C)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.8638 |
| logD: | 2.8218 |
| logSw: | -3.5697 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.015 |
| InChI Key: | XHXKNLXAMWVXFW-UHFFFAOYSA-N |