3-(4-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-4H-1-benzopyran-4-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-4H-1-benzopyran-4-one
3-(4-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | 2712-5138 |
| Compound Name: | 3-(4-chlorophenyl)-8-[(dimethylamino)methyl]-7-hydroxy-4H-1-benzopyran-4-one |
| Molecular Weight: | 329.78 |
| Molecular Formula: | C18 H16 Cl N O3 |
| Smiles: | CN(C)Cc1c(ccc2C(C(=COc12)c1ccc(cc1)[Cl])=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.1792 |
| logD: | 2.666 |
| logSw: | -3.6069 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.98 |
| InChI Key: | LLOZTZGFSFSCOS-UHFFFAOYSA-N |