methyl 3-{[1-(3,4-difluorophenyl)-6-methoxy-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[1-(3,4-difluorophenyl)-6-methoxy-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
methyl 3-{[1-(3,4-difluorophenyl)-6-methoxy-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate
Compound characteristics
Compound ID: | P043-0917 |
Compound Name: | methyl 3-{[1-(3,4-difluorophenyl)-6-methoxy-4-oxo-1,4-dihydropyridazine-3-carbonyl]amino}benzoate |
Molecular Weight: | 415.35 |
Molecular Formula: | C20 H15 F2 N3 O5 |
Smiles: | COC1=CC(C(C(Nc2cccc(c2)C(=O)OC)=O)=NN1c1ccc(c(c1)F)F)=O |
Stereo: | ACHIRAL |
logP: | 3.7393 |
logD: | 3.7299 |
logSw: | -4.1253 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.709 |
InChI Key: | QNKNPXWBIUCWOC-UHFFFAOYSA-N |