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
9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
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: | K832-3100 |
| Compound Name: | 9-(2,3,4-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 356.38 |
| Molecular Formula: | C18 H20 N4 O4 |
| Smiles: | COc1ccc(C2C3=C(CCCC3=O)Nc3ncnn23)c(c1OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0643 |
| logD: | 1.8735 |
| logSw: | -2.9719 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.622 |
| InChI Key: | JYOIESCRKHJHJE-HNNXBMFYSA-N |