{4-methoxy-2-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)oxy]phenyl}(phenyl)methanone
Chemical Structure Depiction of
{4-methoxy-2-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)oxy]phenyl}(phenyl)methanone
{4-methoxy-2-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)oxy]phenyl}(phenyl)methanone
Compound characteristics
| Compound ID: | 8017-1068 |
| Compound Name: | {4-methoxy-2-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)oxy]phenyl}(phenyl)methanone |
| Molecular Weight: | 354.32 |
| Molecular Formula: | C17 H14 N4 O5 |
| Smiles: | Cn1c(nc(n1)[N+]([O-])=O)Oc1cc(ccc1C(c1ccccc1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7247 |
| logD: | 2.7247 |
| logSw: | -3.5878 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 85.036 |
| InChI Key: | BOHXTROWWCXLSH-UHFFFAOYSA-N |