3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(5-methyl-1,2-oxazol-3-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-(5-methyl-1,2-oxazol-3-yl)propanamide
3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide
Compound characteristics
| Compound ID: | J021-2563 |
| Compound Name: | 3-(3-{[(5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)-N-(5-methyl-1,2-oxazol-3-yl)propanamide |
| Molecular Weight: | 363.4 |
| Molecular Formula: | C14 H17 N7 O3 S |
| Smiles: | CCc1nnc([nH]1)SCc1nc(CCC(Nc2cc(C)on2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 1.2075 |
| logD: | 0.873 |
| logSw: | -2.2463 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.014 |
| InChI Key: | DNNJHQNGCJYTAJ-UHFFFAOYSA-N |