4-{[benzyl(2-methylpropyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[benzyl(2-methylpropyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one
4-{[benzyl(2-methylpropyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D456-0155 |
| Compound Name: | 4-{[benzyl(2-methylpropyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 335.45 |
| Molecular Formula: | C22 H25 N O2 |
| Smiles: | CC(C)CN(CC1=CC(=O)Oc2ccc(C)cc12)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5947 |
| logD: | 4.1406 |
| logSw: | -4.4293 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.3574 |
| InChI Key: | OCCGAFGOLAJNFV-UHFFFAOYSA-N |