N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-0406 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C22 H21 N3 O3 |
| Smiles: | C1CN(CCNC(c2c3COc4ccccc4c3on2)=O)Cc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 3.0878 |
| logD: | 2.8698 |
| logSw: | -3.5973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.668 |
| InChI Key: | WCWLEZHUAFEFSL-UHFFFAOYSA-N |