1-(3,4-dihydroisoquinolin-2(1H)-yl)-4-[4-(1H-indol-3-yl)-3,6-dihydropyridin-1(2H)-yl]butane-1,4-dione
Chemical Structure Depiction of
1-(3,4-dihydroisoquinolin-2(1H)-yl)-4-[4-(1H-indol-3-yl)-3,6-dihydropyridin-1(2H)-yl]butane-1,4-dione
1-(3,4-dihydroisoquinolin-2(1H)-yl)-4-[4-(1H-indol-3-yl)-3,6-dihydropyridin-1(2H)-yl]butane-1,4-dione
Compound characteristics
| Compound ID: | C795-1270 |
| Compound Name: | 1-(3,4-dihydroisoquinolin-2(1H)-yl)-4-[4-(1H-indol-3-yl)-3,6-dihydropyridin-1(2H)-yl]butane-1,4-dione |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C26 H27 N3 O2 |
| Smiles: | C1CN(CC=C1c1c[nH]c2ccccc12)C(CCC(N1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.697 |
| logD: | 3.697 |
| logSw: | -4.0495 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.013 |
| InChI Key: | RBCGSDWAOJRUOL-UHFFFAOYSA-N |