methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate
methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate
Compound characteristics
| Compound ID: | C528-0828 |
| Compound Name: | methyl 2-(2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfonyl}acetamido)benzoate |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C22 H22 N2 O7 S |
| Smiles: | Cc1c(CS(CC(Nc2ccccc2C(=O)OC)=O)(=O)=O)nc(c2cccc(c2)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.4223 |
| logD: | 2.3804 |
| logSw: | -3.0909 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.558 |
| InChI Key: | IFBNYFZALLFRJO-UHFFFAOYSA-N |