8-{[butyl(ethyl)amino]methyl}-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-{[butyl(ethyl)amino]methyl}-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
8-{[butyl(ethyl)amino]methyl}-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 3453-0720 |
| Compound Name: | 8-{[butyl(ethyl)amino]methyl}-7-hydroxy-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 351.44 |
| Molecular Formula: | C22 H25 N O3 |
| Smiles: | CCCCN(CC)Cc1c(ccc2C(=CC(=O)Oc12)c1ccccc1)O |
| Stereo: | ACHIRAL |
| logP: | 4.4647 |
| logD: | 4.136 |
| logSw: | -3.9454 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.293 |
| InChI Key: | GOANVLYQSREXOW-UHFFFAOYSA-N |