8-[(dimethylamino)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-[(dimethylamino)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
8-[(dimethylamino)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D635-0129 |
| Compound Name: | 8-[(dimethylamino)methyl]-7-hydroxy-4-propyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 261.32 |
| Molecular Formula: | C15 H19 N O3 |
| Smiles: | CCCC1=CC(=O)Oc2c1ccc(c2CN(C)C)O |
| Stereo: | ACHIRAL |
| logP: | 2.4739 |
| logD: | 1.6972 |
| logSw: | -2.8399 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.765 |
| InChI Key: | NLNXDAFYJKVSNA-UHFFFAOYSA-N |