3-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-2H-1-benzopyran-2-one
3-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8013-3343 |
| Compound Name: | 3-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 303.36 |
| Molecular Formula: | C20 H17 N O2 |
| Smiles: | CC1(C)Cc2ccccc2C(C2=Cc3ccccc3OC2=O)=N1 |
| Stereo: | ACHIRAL |
| logP: | 3.7385 |
| logD: | 3.7385 |
| logSw: | -4.1704 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.7608 |
| InChI Key: | OIMSGYTYUKJLEZ-UHFFFAOYSA-N |