3-benzyl-8-[(dimethylamino)methyl]-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-benzyl-8-[(dimethylamino)methyl]-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
3-benzyl-8-[(dimethylamino)methyl]-7-hydroxy-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D635-0107 |
| Compound Name: | 3-benzyl-8-[(dimethylamino)methyl]-7-hydroxy-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 323.39 |
| Molecular Formula: | C20 H21 N O3 |
| Smiles: | CC1=C(Cc2ccccc2)C(=O)Oc2c1ccc(c2CN(C)C)O |
| Stereo: | ACHIRAL |
| logP: | 3.5074 |
| logD: | 2.7307 |
| logSw: | -3.467 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.008 |
| InChI Key: | JVXCPKHRFJHYFA-UHFFFAOYSA-N |