ethyl 2-{[5-(3-hydroxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(3-hydroxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{[5-(3-hydroxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | C226-1574 |
| Compound Name: | ethyl 2-{[5-(3-hydroxyphenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 412.46 |
| Molecular Formula: | C21 H20 N2 O5 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1cc(c2cccc(c2)O)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4623 |
| logD: | 2.1618 |
| logSw: | -4.159 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.951 |
| InChI Key: | BCAIRCVZEGBAME-UHFFFAOYSA-N |