ethyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate
ethyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | G310-0093 |
| Compound Name: | ethyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C19 H18 N2 O5 S2 |
| Smiles: | CCOC(c1cc(c2ccc(s2)S(N2CCc3ccccc3C2)(=O)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0687 |
| logD: | 4.0687 |
| logSw: | -3.9775 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.919 |
| InChI Key: | QWCGJTKBWIPHTK-UHFFFAOYSA-N |