2-(3,4-dimethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
2-(3,4-dimethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-4015 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-9-(3,4,5-trimethoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 492.53 |
| Molecular Formula: | C26 H28 N4 O6 |
| Smiles: | COc1ccc(cc1OC)c1nc2NC3CCCC(C=3C(c3cc(c(c(c3)OC)OC)OC)n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6061 |
| logD: | 3.5988 |
| logSw: | -3.8982 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.583 |
| InChI Key: | VVJGZLHQJOPODW-QHCPKHFHSA-N |