9-(2-chlorophenyl)-2-[4-(dimethylamino)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(2-chlorophenyl)-2-[4-(dimethylamino)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(2-chlorophenyl)-2-[4-(dimethylamino)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-4591 |
| Compound Name: | 9-(2-chlorophenyl)-2-[4-(dimethylamino)phenyl]-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 419.91 |
| Molecular Formula: | C23 H22 Cl N5 O |
| Smiles: | CN(C)c1ccc(cc1)c1nc2NC3CCCC(C=3C(c3ccccc3[Cl])n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9211 |
| logD: | 4.916 |
| logSw: | -4.9509 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.149 |
| InChI Key: | DREWULQQSAZEHY-NRFANRHFSA-N |