12-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-{5-[(4-propylphenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1,2,4]triazolo[1',5':1,6]pyrimido[4,5-b]quinoline
Chemical Structure Depiction of
12-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-{5-[(4-propylphenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1,2,4]triazolo[1',5':1,6]pyrimido[4,5-b]quinoline
12-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-{5-[(4-propylphenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1,2,4]triazolo[1',5':1,6]pyrimido[4,5-b]quinoline
Compound characteristics
| Compound ID: | Y502-7724 |
| Compound Name: | 12-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-2-{5-[(4-propylphenoxy)methyl]furan-2-yl}-8,9,10,11-tetrahydro[1,2,4]triazolo[1',5':1,6]pyrimido[4,5-b]quinoline |
| Molecular Weight: | 547.66 |
| Molecular Formula: | C32 H33 N7 O2 |
| Smiles: | CCCc1ccc(cc1)OCc1ccc(c2nc3c4c(c5cn(CC)nc5C)c5CCCCc5nc4N=Cn3n2)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.4193 |
| logD: | 5.4599 |
| logSw: | -5.7773 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.018 |
| InChI Key: | IJSPRYHKHNADMD-UHFFFAOYSA-N |