6-chloro-7-[2-(3-nitrophenyl)-2-oxoethoxy]-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-[2-(3-nitrophenyl)-2-oxoethoxy]-4-phenyl-2H-1-benzopyran-2-one
6-chloro-7-[2-(3-nitrophenyl)-2-oxoethoxy]-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-2034 |
| Compound Name: | 6-chloro-7-[2-(3-nitrophenyl)-2-oxoethoxy]-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 435.82 |
| Molecular Formula: | C23 H14 Cl N O6 |
| Smiles: | C(C(c1cccc(c1)[N+]([O-])=O)=O)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0881 |
| logD: | 5.0881 |
| logSw: | -5.4163 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.317 |
| InChI Key: | CMHTVHBQXUVMPE-UHFFFAOYSA-N |