8-methyl-7-[(4-nitrophenyl)methoxy]-4-propyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methyl-7-[(4-nitrophenyl)methoxy]-4-propyl-2H-1-benzopyran-2-one
8-methyl-7-[(4-nitrophenyl)methoxy]-4-propyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7001 |
| Compound Name: | 8-methyl-7-[(4-nitrophenyl)methoxy]-4-propyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 353.37 |
| Molecular Formula: | C20 H19 N O5 |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2C)OCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8966 |
| logD: | 4.8966 |
| logSw: | -4.9129 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.026 |
| InChI Key: | GCCQFCRWJFLKGD-UHFFFAOYSA-N |