methyl 4-[(3-{2-hydroxy-4-[(4-nitrophenyl)methoxy]phenyl}-5-methyl-1H-pyrazol-4-yl)oxy]benzoate
Chemical Structure Depiction of
methyl 4-[(3-{2-hydroxy-4-[(4-nitrophenyl)methoxy]phenyl}-5-methyl-1H-pyrazol-4-yl)oxy]benzoate
methyl 4-[(3-{2-hydroxy-4-[(4-nitrophenyl)methoxy]phenyl}-5-methyl-1H-pyrazol-4-yl)oxy]benzoate
Compound characteristics
| Compound ID: | Y041-2756 |
| Compound Name: | methyl 4-[(3-{2-hydroxy-4-[(4-nitrophenyl)methoxy]phenyl}-5-methyl-1H-pyrazol-4-yl)oxy]benzoate |
| Molecular Weight: | 475.46 |
| Molecular Formula: | C25 H21 N3 O7 |
| Smiles: | Cc1c(c(c2ccc(cc2O)OCc2ccc(cc2)[N+]([O-])=O)n[nH]1)Oc1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.6052 |
| logD: | 5.5992 |
| logSw: | -5.3114 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.328 |
| InChI Key: | CWFYVANULOWZOJ-UHFFFAOYSA-N |