2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-6-[2-(4-ethoxyphenyl)-2-oxoethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one
Chemical Structure Depiction of
2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-6-[2-(4-ethoxyphenyl)-2-oxoethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one
2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-6-[2-(4-ethoxyphenyl)-2-oxoethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one
Compound characteristics
| Compound ID: | G861-0161 |
| Compound Name: | 2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-6-[2-(4-ethoxyphenyl)-2-oxoethyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazolin-5(6H)-one |
| Molecular Weight: | 530.58 |
| Molecular Formula: | C28 H30 N6 O5 |
| Smiles: | CCOc1ccc(cc1)C(CN1C(n2c(c3cc(c(cc13)OC)OC)nc(CCn1c(C)cc(C)n1)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0003 |
| logD: | 2.9987 |
| logSw: | -3.3199 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.702 |
| InChI Key: | MWQHFSBTNIQONZ-UHFFFAOYSA-N |