9-(4-fluorophenyl)-2-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(4-fluorophenyl)-2-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(4-fluorophenyl)-2-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-4069 |
| Compound Name: | 9-(4-fluorophenyl)-2-(3,4,5-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: | COc1cc(cc(c1OC)OC)c1nc2NC3CCCC(C=3C(c3ccc(cc3)F)n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7653 |
| logD: | 3.7579 |
| logSw: | -4.1396 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.323 |
| InChI Key: | CXSLXEYIFSRUQN-NRFANRHFSA-N |