ethyl 2-[(5-ethyl-1,2-oxazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[(5-ethyl-1,2-oxazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[(5-ethyl-1,2-oxazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | C226-2828 |
| Compound Name: | ethyl 2-[(5-ethyl-1,2-oxazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 348.42 |
| Molecular Formula: | C17 H20 N2 O4 S |
| Smiles: | CCc1cc(C(Nc2c(C(=O)OCC)c3CCCCc3s2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.0372 |
| logD: | 1.3452 |
| logSw: | -4.1135 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.775 |
| InChI Key: | QXOFBIBGFXVHSK-UHFFFAOYSA-N |