2-chloro-N-[2-ethyl-3-(4-fluorophenyl)-6-oxopyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl]benzamide
Chemical Structure Depiction of
2-chloro-N-[2-ethyl-3-(4-fluorophenyl)-6-oxopyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl]benzamide
2-chloro-N-[2-ethyl-3-(4-fluorophenyl)-6-oxopyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl]benzamide
Compound characteristics
Compound ID: | Y020-9206 |
Compound Name: | 2-chloro-N-[2-ethyl-3-(4-fluorophenyl)-6-oxopyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-7(6H)-yl]benzamide |
Molecular Weight: | 462.87 |
Molecular Formula: | C23 H16 Cl F N6 O2 |
Smiles: | CCc1c(c2ccc(cc2)F)c2N=NC3=C(C=CN(C3=O)NC(c3ccccc3[Cl])=O)n2n1 |
Stereo: | ACHIRAL |
logP: | 4.2504 |
logD: | 2.8449 |
logSw: | -4.7198 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.3 |
InChI Key: | GQCKQZZHEOUEOU-UHFFFAOYSA-N |