methyl 4-(2-{[5-(1-methyl-1H-indol-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 4-(2-{[5-(1-methyl-1H-indol-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)benzoate
methyl 4-(2-{[5-(1-methyl-1H-indol-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | D386-0756 |
| Compound Name: | methyl 4-(2-{[5-(1-methyl-1H-indol-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C21 H18 N4 O4 S |
| Smiles: | Cn1c(cc2ccccc12)c1nnc(o1)SCC(Nc1ccc(cc1)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.429 |
| logD: | 3.4289 |
| logSw: | -3.7672 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.923 |
| InChI Key: | WLWKYIAQROSWPE-UHFFFAOYSA-N |