2-(3-chlorophenyl)-9-(2-ethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-9-(2-ethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
2-(3-chlorophenyl)-9-(2-ethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
Compound ID: | 5225-5213 |
Compound Name: | 2-(3-chlorophenyl)-9-(2-ethoxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
Molecular Weight: | 448.95 |
Molecular Formula: | C25 H25 Cl N4 O2 |
Smiles: | CCOc1ccccc1C1C2=C(CC(C)(C)CC2=O)Nc2nc(c3cccc(c3)[Cl])nn12 |
Stereo: | RACEMIC MIXTURE |
logP: | 6.0627 |
logD: | 6.0447 |
logSw: | -6.0138 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.555 |
InChI Key: | KVOXDXHSFITRLK-QFIPXVFZSA-N |