6-(4-fluorophenyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
6-(4-fluorophenyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
6-(4-fluorophenyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | Y020-6430 |
| Compound Name: | 6-(4-fluorophenyl)-9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 450.47 |
| Molecular Formula: | C24 H23 F N4 O4 |
| Smiles: | COc1ccc(C2C3=C(CC(CC3=O)c3ccc(cc3)F)Nc3ncnn23)c(c1OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8957 |
| logD: | 3.4017 |
| logSw: | -4.1843 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.35 |
| InChI Key: | MKRXKXXUJNWMCC-UHFFFAOYSA-N |