6-[(2-chlorophenyl)methyl]-3-(4-ethoxyanilino)-1,2,4-triazin-5(4H)-one
Chemical Structure Depiction of
6-[(2-chlorophenyl)methyl]-3-(4-ethoxyanilino)-1,2,4-triazin-5(4H)-one
6-[(2-chlorophenyl)methyl]-3-(4-ethoxyanilino)-1,2,4-triazin-5(4H)-one
Compound characteristics
Compound ID: | C102-0517 |
Compound Name: | 6-[(2-chlorophenyl)methyl]-3-(4-ethoxyanilino)-1,2,4-triazin-5(4H)-one |
Molecular Weight: | 356.81 |
Molecular Formula: | C18 H17 Cl N4 O2 |
Smiles: | CCOc1ccc(cc1)NC1NC(C(Cc2ccccc2[Cl])=NN=1)=O |
Stereo: | ACHIRAL |
logP: | 4.4106 |
logD: | 4.4104 |
logSw: | -4.3339 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 61.879 |
InChI Key: | UEDDQGCUCHWKCK-UHFFFAOYSA-N |