3-benzyl-7-[2-(hydroxyimino)-2-(4-methylphenyl)ethoxy]-4,8-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-7-[2-(hydroxyimino)-2-(4-methylphenyl)ethoxy]-4,8-dimethyl-2H-1-benzopyran-2-one
3-benzyl-7-[2-(hydroxyimino)-2-(4-methylphenyl)ethoxy]-4,8-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 2259-4074 |
| Compound Name: | 3-benzyl-7-[2-(hydroxyimino)-2-(4-methylphenyl)ethoxy]-4,8-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C27 H25 N O4 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2C)OCC(/c1ccc(C)cc1)=N/O |
| Stereo: | ACHIRAL |
| logP: | 5.8312 |
| logD: | 5.8311 |
| logSw: | -5.5957 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.391 |
| InChI Key: | TTXILKDUFBKGQG-UHFFFAOYSA-N |