3-benzyl-6-chloro-7-[(2-methoxy-5-nitrophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-6-chloro-7-[(2-methoxy-5-nitrophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
3-benzyl-6-chloro-7-[(2-methoxy-5-nitrophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y042-8276 |
| Compound Name: | 3-benzyl-6-chloro-7-[(2-methoxy-5-nitrophenyl)methoxy]-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 465.89 |
| Molecular Formula: | C25 H20 Cl N O6 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2cc(c(cc12)[Cl])OCc1cc(ccc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2114 |
| logD: | 6.2114 |
| logSw: | -6.1036 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.215 |
| InChI Key: | RMEAIUSXCGZFLN-UHFFFAOYSA-N |