2-[(4-amino-5-{3-[(propan-2-yl)oxy]phenyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[(4-amino-5-{3-[(propan-2-yl)oxy]phenyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
2-[(4-amino-5-{3-[(propan-2-yl)oxy]phenyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | IB08-5149 |
| Compound Name: | 2-[(4-amino-5-{3-[(propan-2-yl)oxy]phenyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C19 H20 F N5 O2 S |
| Smiles: | CC(C)Oc1cccc(c1)c1nnc(n1N)SCC(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.28 |
| logD: | 3.28 |
| logSw: | -4.07 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 165.1 |
| InChI Key: | BUSOGANAAFEPLO-UHFFFAOYSA-N |