8-[(azepan-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-[(azepan-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
8-[(azepan-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 4248-0075 |
| Compound Name: | 8-[(azepan-1-yl)methyl]-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 349.43 |
| Molecular Formula: | C22 H23 N O3 |
| Smiles: | C1CCCN(CC1)Cc1c(ccc2C(=CC(=O)Oc12)c1ccccc1)O |
| Stereo: | ACHIRAL |
| logP: | 4.0839 |
| logD: | 3.7906 |
| logSw: | -3.9352 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.67 |
| InChI Key: | UHPPTGUPKCCNTR-UHFFFAOYSA-N |