9-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
| Compound ID: | 5225-3875 |
| Compound Name: | 9-(4-chlorophenyl)-2-(4-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
| Molecular Weight: | 406.87 |
| Molecular Formula: | C22 H19 Cl N4 O2 |
| Smiles: | COc1ccc(cc1)c1nc2NC3CCCC(C=3C(c3ccc(cc3)[Cl])n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8309 |
| logD: | 4.8235 |
| logSw: | -5.1613 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.888 |
| InChI Key: | VCRRPOBYYREAAF-FQEVSTJZSA-N |