4-{[benzyl(propyl)amino]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[benzyl(propyl)amino]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one
4-{[benzyl(propyl)amino]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D456-0658 |
| Compound Name: | 4-{[benzyl(propyl)amino]methyl}-6,8-dimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 335.45 |
| Molecular Formula: | C22 H25 N O2 |
| Smiles: | CCCN(CC1=CC(=O)Oc2c(C)cc(C)cc12)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8627 |
| logD: | 3.8538 |
| logSw: | -4.5418 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.0201 |
| InChI Key: | GFEABUBPHMPELP-UHFFFAOYSA-N |