1-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxyphenyl}-N-(4H-1,2,4-triazol-4-yl)methanimine
Chemical Structure Depiction of
1-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxyphenyl}-N-(4H-1,2,4-triazol-4-yl)methanimine
1-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxyphenyl}-N-(4H-1,2,4-triazol-4-yl)methanimine
Compound characteristics
| Compound ID: | 5277-0325 |
| Compound Name: | 1-{3-[(2-chloro-5-fluoropyrimidin-4-yl)oxy]-4-methoxyphenyl}-N-(4H-1,2,4-triazol-4-yl)methanimine |
| Molecular Weight: | 348.72 |
| Molecular Formula: | C14 H10 Cl F N6 O2 |
| Smiles: | COc1ccc(/C=N/n2cnnc2)cc1Oc1c(cnc(n1)[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 1.8008 |
| logD: | 1.8005 |
| logSw: | -2.6134 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.255 |
| InChI Key: | ISIYJVKHYVUUMF-UHFFFAOYSA-N |