2-[4-(dimethylamino)phenyl]-6,6-dimethyl-9-(pyridin-3-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
2-[4-(dimethylamino)phenyl]-6,6-dimethyl-9-(pyridin-3-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
2-[4-(dimethylamino)phenyl]-6,6-dimethyl-9-(pyridin-3-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-5519 |
| Compound Name: | 2-[4-(dimethylamino)phenyl]-6,6-dimethyl-9-(pyridin-3-yl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C24 H26 N6 O |
| Smiles: | CC1(C)CC2=C(C(c3cccnc3)n3c(N2)nc(c2ccc(cc2)N(C)C)n3)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7856 |
| logD: | 3.7629 |
| logSw: | -3.836 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.667 |
| InChI Key: | PXAUAIUNTPWNOJ-NRFANRHFSA-N |