N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[5-(4-chlorophenoxy)-2-(3-chlorophenyl)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[5-(4-chlorophenoxy)-2-(3-chlorophenyl)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[5-(4-chlorophenoxy)-2-(3-chlorophenyl)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzamide
Compound characteristics
Compound ID: | V027-4231 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-{[5-(4-chlorophenoxy)-2-(3-chlorophenyl)-3-oxo-2,3-dihydropyridazin-4-yl]amino}benzamide |
Molecular Weight: | 601.45 |
Molecular Formula: | C31 H22 Cl2 N4 O5 |
Salt: | not_available |
Smiles: | C(c1ccc2c(c1)OCO2)NC(c1cccc(c1)NC1=C(C=NN(C1=O)c1cccc(c1)[Cl])Oc1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 6.3898 |
logD: | 6.3594 |
logSw: | -6.5457 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 84.845 |
InChI Key: | QTPXFUMAOKWQIT-UHFFFAOYSA-N |