6-chloro-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
6-chloro-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7192 |
| Compound Name: | 6-chloro-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C22 H14 Cl N O5 |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Oc1cc2c(cc1[Cl])C(=CC(=O)O2)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4192 |
| logD: | 5.4192 |
| logSw: | -5.9837 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.07 |
| InChI Key: | CCTZDIPDSGVQQF-UHFFFAOYSA-N |