1-(2-hydroxyphenyl)-3-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}prop-2-en-1-one
Chemical Structure Depiction of
1-(2-hydroxyphenyl)-3-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}prop-2-en-1-one
1-(2-hydroxyphenyl)-3-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}prop-2-en-1-one
Compound characteristics
| Compound ID: | Y505-4597 |
| Compound Name: | 1-(2-hydroxyphenyl)-3-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]phenyl}prop-2-en-1-one |
| Molecular Weight: | 419.43 |
| Molecular Formula: | C24 H21 N O6 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)OCc1cc(/C=C/C(c2ccccc2O)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.9419 |
| logD: | 5.9075 |
| logSw: | -5.3524 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.701 |
| InChI Key: | TYBDFYGXKOVOPG-UHFFFAOYSA-N |