ethyl 6-methyl-2-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-methyl-2-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-methyl-2-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | D321-1144 |
| Compound Name: | ethyl 6-methyl-2-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C23 H26 N4 O4 S |
| Smiles: | CCOC(c1c2CCC(C)Cc2sc1NC(CCCc1nc(c2cccnc2)no1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8659 |
| logD: | 3.8659 |
| logSw: | -3.9356 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.446 |
| InChI Key: | IBOGLMGPKQBEHW-CQSZACIVSA-N |