3-benzyl-4,8-dimethyl-7-{2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazinylidene]ethoxy}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-4,8-dimethyl-7-{2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazinylidene]ethoxy}-2H-1-benzopyran-2-one
3-benzyl-4,8-dimethyl-7-{2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazinylidene]ethoxy}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 2259-4067 |
| Compound Name: | 3-benzyl-4,8-dimethyl-7-{2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazinylidene]ethoxy}-2H-1-benzopyran-2-one |
| Molecular Weight: | 547.61 |
| Molecular Formula: | C33 H29 N3 O5 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OCC(/c1ccc(C)cc1)=N/Nc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 8.0852 |
| logD: | 8.0851 |
| logSw: | -5.8914 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.005 |
| InChI Key: | UWUIPFSRHWGWLS-UHFFFAOYSA-N |