6-hexyl-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-hexyl-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
6-hexyl-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7256 |
| Compound Name: | 6-hexyl-7-[(4-nitrophenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C28 H27 N O5 |
| Smiles: | CCCCCCc1cc2C(=CC(=O)Oc2cc1OCc1ccc(cc1)[N+]([O-])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 7.5832 |
| logD: | 7.5832 |
| logSw: | -5.6436 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.07 |
| InChI Key: | IVDARYVRVXFMIG-UHFFFAOYSA-N |