8-[(azepan-1-yl)methyl]-7-hydroxy-3-phenyl-4H-1-benzopyran-4-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
8-[(azepan-1-yl)methyl]-7-hydroxy-3-phenyl-4H-1-benzopyran-4-one--hydrogen chloride (1/1)
8-[(azepan-1-yl)methyl]-7-hydroxy-3-phenyl-4H-1-benzopyran-4-one--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 3232-0313 |
| Compound Name: | 8-[(azepan-1-yl)methyl]-7-hydroxy-3-phenyl-4H-1-benzopyran-4-one--hydrogen chloride (1/1) |
| Molecular Weight: | 385.89 |
| Molecular Formula: | C22 H23 N O3 |
| Salt: | HCl |
| Smiles: | C1CCCN(CC1)Cc1c(ccc2C(C(=COc12)c1ccccc1)=O)O |
| Stereo: | ACHIRAL |
| logP: | 4.0076 |
| logD: | 3.6324 |
| logSw: | -3.8778 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.156 |
| InChI Key: | OUZLXGYFLIOSOY-UHFFFAOYSA-N |