N-(5-methyl-1,2-oxazol-3-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-1,2-oxazol-3-yl)-3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(5-methyl-1,2-oxazol-3-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: | J021-2383 |
| Compound Name: | N-(5-methyl-1,2-oxazol-3-yl)-3-(3-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
| Molecular Weight: | 411.44 |
| Molecular Formula: | C18 H17 N7 O3 S |
| Smiles: | Cc1cc(NC(CCc2nc(CSc3nnc(c4ccccc4)[nH]3)no2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.3617 |
| logD: | 1.161 |
| logSw: | -2.9826 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.752 |
| InChI Key: | XAXXVKDFARMDHQ-UHFFFAOYSA-N |