N-(4-chloro-2-fluorophenyl)-2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-oxo[1,2,4]triazolo[1,5-c]quinazolin-6(5H)-yl}acetamide
Chemical Structure Depiction of
N-(4-chloro-2-fluorophenyl)-2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-oxo[1,2,4]triazolo[1,5-c]quinazolin-6(5H)-yl}acetamide
N-(4-chloro-2-fluorophenyl)-2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-oxo[1,2,4]triazolo[1,5-c]quinazolin-6(5H)-yl}acetamide
Compound characteristics
| Compound ID: | C695-0125 |
| Compound Name: | N-(4-chloro-2-fluorophenyl)-2-{2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-oxo[1,2,4]triazolo[1,5-c]quinazolin-6(5H)-yl}acetamide |
| Molecular Weight: | 493.93 |
| Molecular Formula: | C24 H21 Cl F N7 O2 |
| Smiles: | Cc1cc(C)n(CCc2nc3c4ccccc4N(CC(Nc4ccc(cc4F)[Cl])=O)C(n3n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0744 |
| logD: | 3.0658 |
| logSw: | -3.6724 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.523 |
| InChI Key: | NWIVJYAJKKEXDC-UHFFFAOYSA-N |