6-{[benzyl(methyl)amino]methyl}-7-hydroxy-3,4,8-trimethyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-{[benzyl(methyl)amino]methyl}-7-hydroxy-3,4,8-trimethyl-2H-1-benzopyran-2-one
6-{[benzyl(methyl)amino]methyl}-7-hydroxy-3,4,8-trimethyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-3555 |
| Compound Name: | 6-{[benzyl(methyl)amino]methyl}-7-hydroxy-3,4,8-trimethyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 337.42 |
| Molecular Formula: | C21 H23 N O3 |
| Smiles: | CC1=C(C)c2cc(CN(C)Cc3ccccc3)c(c(C)c2OC1=O)O |
| Stereo: | ACHIRAL |
| logP: | 4.3859 |
| logD: | 3.736 |
| logSw: | -4.3749 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.168 |
| InChI Key: | BJEXHFQZHGWYSI-UHFFFAOYSA-N |