2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Chemical Structure Depiction of
2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide
Compound characteristics
| Compound ID: | IB03-9236 |
| Compound Name: | 2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)acetamide |
| Molecular Weight: | 344.39 |
| Molecular Formula: | C15 H16 N6 O2 S |
| Smiles: | Cc1cc(NC(CSc2nnc(c3ccc(cc3)N)n2C)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 1.5 |
| logD: | 1.48 |
| logSw: | -2.49 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 222.49 |
| InChI Key: | KWOKAZXYVBXAIV-UHFFFAOYSA-N |