ethyl 5-acetyl-2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-acetyl-2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4-methylthiophene-3-carboxylate
ethyl 5-acetyl-2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | C226-1123 |
| Compound Name: | ethyl 5-acetyl-2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C22 H22 N2 O7 S |
| Smiles: | CCOC(c1c(C)c(C(C)=O)sc1NC(c1cc(c2ccc(c(c2)OC)OC)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3446 |
| logD: | 0.4942 |
| logSw: | -3.6874 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.501 |
| InChI Key: | KVAMNFOJCAPTCR-UHFFFAOYSA-N |