3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide
Chemical Structure Depiction of
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide
Compound characteristics
| Compound ID: | J021-2202 |
| Compound Name: | 3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(2-methyl-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)propanamide |
| Molecular Weight: | 441.47 |
| Molecular Formula: | C19 H19 N7 O4 S |
| Smiles: | CCc1nnc([nH]1)SCc1nc(CCC(Nc2ccc3C(N(C)C(c3c2)=O)=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 1.3554 |
| logD: | 1.0209 |
| logSw: | -2.5334 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 118.509 |
| InChI Key: | CUCSWRMGKBAPBF-UHFFFAOYSA-N |