4-benzyl-1-(4-chlorophenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
4-benzyl-1-(4-chlorophenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
4-benzyl-1-(4-chlorophenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Compound characteristics
| Compound ID: | E143-0005 |
| Compound Name: | 4-benzyl-1-(4-chlorophenyl)[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one |
| Molecular Weight: | 386.84 |
| Molecular Formula: | C22 H15 Cl N4 O |
| Smiles: | C(c1ccccc1)N1C(c2ccccc2n2c(c3ccc(cc3)[Cl])nnc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7255 |
| logD: | 4.7255 |
| logSw: | -5.0558 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.73 |
| InChI Key: | XKQFEWBBRJFMHF-UHFFFAOYSA-N |