ethyl 2-{[5-(3-chlorophenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[5-(3-chlorophenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{[5-(3-chlorophenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | C226-1460 |
| Compound Name: | ethyl 2-{[5-(3-chlorophenyl)-1,2-oxazole-3-carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 430.91 |
| Molecular Formula: | C21 H19 Cl N2 O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1cc(c2cccc(c2)[Cl])on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5181 |
| logD: | 3.2176 |
| logSw: | -5.9272 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.334 |
| InChI Key: | OFJMEGHTLUXIPI-UHFFFAOYSA-N |