6-chloro-4-(4-methoxyphenyl)-7-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-4-(4-methoxyphenyl)-7-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
6-chloro-4-(4-methoxyphenyl)-7-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-2017 |
| Compound Name: | 6-chloro-4-(4-methoxyphenyl)-7-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 437.84 |
| Molecular Formula: | C23 H16 Cl N O6 |
| Smiles: | COc1ccc(cc1)C1=CC(=O)Oc2cc(c(cc12)[Cl])OCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5067 |
| logD: | 5.5067 |
| logSw: | -5.9875 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.614 |
| InChI Key: | APYVVATWEFWWMO-UHFFFAOYSA-N |