9-(3-fluorophenyl)-6-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(3-fluorophenyl)-6-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(3-fluorophenyl)-6-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | C202-3960 |
| Compound Name: | 9-(3-fluorophenyl)-6-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 390.42 |
| Molecular Formula: | C22 H19 F N4 O2 |
| Smiles: | COc1ccc(cc1)C1CC2=C(C(c3cccc(c3)F)n3c(N2)ncn3)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0267 |
| logD: | 3.5326 |
| logSw: | -4.2273 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.829 |
| InChI Key: | VAGMODVMQRSINV-UHFFFAOYSA-N |