9-(3-ethoxy-4-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Chemical Structure Depiction of
9-(3-ethoxy-4-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
9-(3-ethoxy-4-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one
Compound characteristics
Compound ID: | 6359-0265 |
Compound Name: | 9-(3-ethoxy-4-hydroxyphenyl)-6,6-dimethyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8(4H)-one |
Molecular Weight: | 354.41 |
Molecular Formula: | C19 H22 N4 O3 |
Smiles: | CCOc1cc(ccc1O)C1C2=C(CC(C)(C)CC2=O)Nc2ncnn12 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.526 |
logD: | 2.1534 |
logSw: | -2.7723 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.315 |
InChI Key: | NETOHLVPMQJQPO-KRWDZBQOSA-N |