methyl 2-(2-{[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-(2-{[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 2-(2-{[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y502-9876 |
| Compound Name: | methyl 2-(2-{[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C18 H17 N3 O5 S2 |
| Smiles: | COC(c1c2CCCCc2sc1NC(CSc1nnc(c2ccco2)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7925 |
| logD: | 0.7413 |
| logSw: | -3.2873 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.681 |
| InChI Key: | WIGSEVLHRPYRFQ-UHFFFAOYSA-N |