4-{5-(3-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}aniline
Chemical Structure Depiction of
4-{5-(3-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}aniline
4-{5-(3-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}aniline
Compound characteristics
| Compound ID: | V028-0129 |
| Compound Name: | 4-{5-(3-fluorophenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}aniline |
| Molecular Weight: | 312.34 |
| Molecular Formula: | C17 H17 F N4 O |
| Salt: | not_available |
| Smiles: | CC(C)Oc1nc(c2cccc(c2)F)n(c2ccc(cc2)N)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.6601 |
| logD: | 3.6599 |
| logSw: | -3.984 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.299 |
| InChI Key: | RHTWZNSWQRHSQD-UHFFFAOYSA-N |