5-[(2-methoxy-5-nitrophenyl)methoxy]-7-methyl-4-propyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
5-[(2-methoxy-5-nitrophenyl)methoxy]-7-methyl-4-propyl-2H-1-benzopyran-2-one
5-[(2-methoxy-5-nitrophenyl)methoxy]-7-methyl-4-propyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7394 |
| Compound Name: | 5-[(2-methoxy-5-nitrophenyl)methoxy]-7-methyl-4-propyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 383.4 |
| Molecular Formula: | C21 H21 N O6 |
| Smiles: | CCCC1=CC(=O)Oc2cc(C)cc(c12)OCc1cc(ccc1OC)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8252 |
| logD: | 4.8252 |
| logSw: | -4.9195 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.972 |
| InChI Key: | DZKLELTXUSDUDJ-UHFFFAOYSA-N |