dimethyl 5-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methylphenyl)glycyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methylphenyl)glycyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methylphenyl)glycyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C436-2049 |
| Compound Name: | dimethyl 5-{[N-(3,5-dimethyl-1,2-oxazole-4-sulfonyl)-N-(4-methylphenyl)glycyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 515.54 |
| Molecular Formula: | C24 H25 N3 O8 S |
| Smiles: | Cc1ccc(cc1)N(CC(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)S(c1c(C)noc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7303 |
| logD: | 3.7302 |
| logSw: | -4.0005 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.327 |
| InChI Key: | RBHABHQZNZWRDD-UHFFFAOYSA-N |