4-{[benzyl(2-methylpropyl)amino]methyl}-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[benzyl(2-methylpropyl)amino]methyl}-6-methoxy-2H-1-benzopyran-2-one
4-{[benzyl(2-methylpropyl)amino]methyl}-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D456-0443 |
| Compound Name: | 4-{[benzyl(2-methylpropyl)amino]methyl}-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 351.44 |
| Molecular Formula: | C22 H25 N O3 |
| Smiles: | CC(C)CN(CC1=CC(=O)Oc2ccc(cc12)OC)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3036 |
| logD: | 4.2266 |
| logSw: | -4.4159 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.901 |
| InChI Key: | VCUBIMICEHWDBU-UHFFFAOYSA-N |