9-(2-chlorophenyl)-2-(3-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(2-chlorophenyl)-2-(3-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(2-chlorophenyl)-2-(3-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-4231 |
| Compound Name: | 9-(2-chlorophenyl)-2-(3-hydroxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 392.84 |
| Molecular Formula: | C21 H17 Cl N4 O2 |
| Smiles: | C1CC2=C(C(c3ccccc3[Cl])n3c(N2)nc(c2cccc(c2)O)n3)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4363 |
| logD: | 4.3566 |
| logSw: | -4.2474 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.962 |
| InChI Key: | XFHDWEFUXFCEJF-IBGZPJMESA-N |