9-(2-chlorophenyl)-6,6-dimethyl-2-(3-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(2-chlorophenyl)-6,6-dimethyl-2-(3-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(2-chlorophenyl)-6,6-dimethyl-2-(3-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-4711 |
| Compound Name: | 9-(2-chlorophenyl)-6,6-dimethyl-2-(3-methylphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 418.93 |
| Molecular Formula: | C24 H23 Cl N4 O |
| Smiles: | Cc1cccc(c1)c1nc2NC3CC(C)(C)CC(C=3C(c3ccccc3[Cl])n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8059 |
| logD: | 5.7935 |
| logSw: | -5.9444 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.345 |
| InChI Key: | JBAYHJAYAGBBQK-NRFANRHFSA-N |