methyl 5-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanamido}-3-propoxy-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 5-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanamido}-3-propoxy-1-benzothiophene-2-carboxylate
methyl 5-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanamido}-3-propoxy-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | L312-0211 |
| Compound Name: | methyl 5-{3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]propanamido}-3-propoxy-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C25 H25 N3 O5 S |
| Smiles: | CCCOc1c2cc(ccc2sc1C(=O)OC)NC(CCc1nc(c2ccc(C)cc2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9137 |
| logD: | 5.9137 |
| logSw: | -5.4914 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.971 |
| InChI Key: | JLEFEQHDVYEJJP-UHFFFAOYSA-N |