6-(furan-2-yl)-9-[4-(propan-2-yl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
6-(furan-2-yl)-9-[4-(propan-2-yl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
6-(furan-2-yl)-9-[4-(propan-2-yl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
Compound ID: | Y020-6196 |
Compound Name: | 6-(furan-2-yl)-9-[4-(propan-2-yl)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
Molecular Weight: | 374.44 |
Molecular Formula: | C22 H22 N4 O2 |
Smiles: | CC(C)c1ccc(cc1)C1C2=C(CC(CC2=O)c2ccco2)Nc2ncnn12 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.4146 |
logD: | 4.0073 |
logSw: | -4.2518 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.864 |
InChI Key: | WOTJNLLYGXVBTQ-UHFFFAOYSA-N |