N-[2-(4-chlorophenyl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
N-[2-(4-chlorophenyl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide
Compound characteristics
Compound ID: | C786-2406 |
Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-(9-methoxy-4-methyl-1-oxo[1,2,4]triazino[4,5-a]indol-2(1H)-yl)acetamide |
Molecular Weight: | 424.89 |
Molecular Formula: | C22 H21 Cl N4 O3 |
Smiles: | CC1=NN(CC(NCCc2ccc(cc2)[Cl])=O)C(c2cc3c(cccc3n12)OC)=O |
Stereo: | ACHIRAL |
logP: | 2.9991 |
logD: | 2.9991 |
logSw: | -3.5031 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.319 |
InChI Key: | HFZYUUIQOBLHFL-UHFFFAOYSA-N |