2-[(4-chlorophenyl)methyl]-N-(4-ethylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Chemical Structure Depiction of
2-[(4-chlorophenyl)methyl]-N-(4-ethylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
2-[(4-chlorophenyl)methyl]-N-(4-ethylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine
Compound characteristics
Compound ID: | G702-6948 |
Compound Name: | 2-[(4-chlorophenyl)methyl]-N-(4-ethylphenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-amine |
Molecular Weight: | 417.94 |
Molecular Formula: | C24 H24 Cl N5 |
Smiles: | CCc1ccc(cc1)NC1=C2CCCCC2=Nc2nc(Cc3ccc(cc3)[Cl])nn12 |
Stereo: | ACHIRAL |
logP: | 6.2625 |
logD: | 6.2625 |
logSw: | -6.2959 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 42.883 |
InChI Key: | TXPMNHXXYVTSFF-UHFFFAOYSA-N |