7,8-dimethyl-4-({methyl[(4-methylphenyl)methyl]amino}methyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7,8-dimethyl-4-({methyl[(4-methylphenyl)methyl]amino}methyl)-2H-1-benzopyran-2-one
7,8-dimethyl-4-({methyl[(4-methylphenyl)methyl]amino}methyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D456-0749 |
| Compound Name: | 7,8-dimethyl-4-({methyl[(4-methylphenyl)methyl]amino}methyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C21 H23 N O2 |
| Smiles: | Cc1ccc(CN(C)CC2=CC(=O)Oc3c2ccc(C)c3C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.508 |
| logD: | 3.7982 |
| logSw: | -4.3762 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.1742 |
| InChI Key: | WEUPTBBNWLQLAB-UHFFFAOYSA-N |