methyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
methyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate
methyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | G310-1828 |
| Compound Name: | methyl 5-[5-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)thiophen-2-yl]-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 404.46 |
| Molecular Formula: | C18 H16 N2 O5 S2 |
| Smiles: | COC(c1cc(c2ccc(s2)S(N2CCc3ccccc3C2)(=O)=O)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6137 |
| logD: | 3.6137 |
| logSw: | -3.7507 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 75.339 |
| InChI Key: | OBBCFKMVJFWNPI-UHFFFAOYSA-N |