N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-9-methyl-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-9-methyl-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-9-methyl-4H-thieno[3,2-c][1]benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | C712-0206 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-9-methyl-4H-thieno[3,2-c][1]benzopyran-2-carboxamide |
| Molecular Weight: | 418.56 |
| Molecular Formula: | C25 H26 N2 O2 S |
| Smiles: | Cc1cccc2c1c1c(CO2)cc(C(NCCCN2CCc3ccccc3C2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5238 |
| logD: | 3.374 |
| logSw: | -4.3219 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.254 |
| InChI Key: | NYIZAIJQOVJQLS-UHFFFAOYSA-N |