[4-({1-[(2-fluorophenyl)methyl]-3-nitro-1H-1,2,4-triazol-5-yl}oxy)-3-methoxyphenyl]methanol
Chemical Structure Depiction of
[4-({1-[(2-fluorophenyl)methyl]-3-nitro-1H-1,2,4-triazol-5-yl}oxy)-3-methoxyphenyl]methanol
[4-({1-[(2-fluorophenyl)methyl]-3-nitro-1H-1,2,4-triazol-5-yl}oxy)-3-methoxyphenyl]methanol
Compound characteristics
| Compound ID: | 7482-1833 |
| Compound Name: | [4-({1-[(2-fluorophenyl)methyl]-3-nitro-1H-1,2,4-triazol-5-yl}oxy)-3-methoxyphenyl]methanol |
| Molecular Weight: | 374.33 |
| Molecular Formula: | C17 H15 F N4 O5 |
| Smiles: | COc1cc(CO)ccc1Oc1nc(nn1Cc1ccccc1F)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.4705 |
| logD: | 2.4705 |
| logSw: | -2.5511 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.213 |
| InChI Key: | BAGCGHDJIDFEGF-UHFFFAOYSA-N |