N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
| Compound ID: | J021-1351 |
| Compound Name: | N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
| Molecular Weight: | 428.49 |
| Molecular Formula: | C17 H16 N8 O2 S2 |
| Smiles: | Cc1nnc(NC(CCc2nc(CSc3nnc(c4ccccc4)[nH]3)no2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 1.8146 |
| logD: | 0.6139 |
| logSw: | -2.3743 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 111.308 |
| InChI Key: | WCHFEWDHTAXOCG-UHFFFAOYSA-N |