ethyl 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 2-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 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: | D321-1109 |
| Compound Name: | ethyl 2-{4-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]butanamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 440.52 |
| Molecular Formula: | C22 H24 N4 O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CCCc1nc(c2cccnc2)no1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.432 |
| logD: | 3.432 |
| logSw: | -3.6017 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.446 |
| InChI Key: | UMMPJQGAGWFPNW-UHFFFAOYSA-N |