ethyl 2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | C226-1118 |
| Compound Name: | ethyl 2-{[5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C23 H24 N2 O6 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1cc(c2ccc(c(c2)OC)OC)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4795 |
| logD: | 2.179 |
| logSw: | -4.4832 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.594 |
| InChI Key: | JCCITQKQEWTOBU-UHFFFAOYSA-N |