4-[(2,3-dimethylanilino)methyl]-6-hydroxy-7-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-[(2,3-dimethylanilino)methyl]-6-hydroxy-7-methyl-2H-1-benzopyran-2-one
4-[(2,3-dimethylanilino)methyl]-6-hydroxy-7-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-2622 |
| Compound Name: | 4-[(2,3-dimethylanilino)methyl]-6-hydroxy-7-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 309.36 |
| Molecular Formula: | C19 H19 N O3 |
| Smiles: | Cc1cc2c(cc1O)C(CNc1cccc(C)c1C)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.9858 |
| logD: | 3.9847 |
| logSw: | -3.7925 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.731 |
| InChI Key: | JWYHLCBGQOKZHP-UHFFFAOYSA-N |