4-{[benzyl(propyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-{[benzyl(propyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one
4-{[benzyl(propyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D456-0154 |
| Compound Name: | 4-{[benzyl(propyl)amino]methyl}-6-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 321.42 |
| Molecular Formula: | C21 H23 N O2 |
| Smiles: | CCCN(CC1=CC(=O)Oc2ccc(C)cc12)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1411 |
| logD: | 3.699 |
| logSw: | -4.1482 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.3358 |
| InChI Key: | ZTFAXFDSRFLDDH-UHFFFAOYSA-N |