C16H14N2O2Cl2 | Cheminformatics

N'-(2,3-dichlorophenyl)-N-[(4-methylphenyl)methyl]oxamide

Formula:C16H14N2O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-(2,3-dichlorophenyl)-N-[(4-methylphenyl)methyl]oxamide is a drug-like molecule.

MolNameN'-(2,3-dichlorophenyl)-N-[(4-methylphenyl)methyl]oxamide
MolecularFormulaC16H14N2O2Cl2
SmilesCc1ccc(CNC(C(Nc2cccc(Cl)c2Cl)=O)=O)cc1
InChIInChI=1S/C16H14Cl2N2O2/c1-10-5-7-11(8-6-10)9-19-15(21)16(22)20-13-4-2-3-12(17)14(13)18/h2-8H,9H2,1H3,(H,19,21)(H,20,22)
InChIKVIGSVSWWWYCFKE-UHFFFAOYSA-N
TotalMolweight337.205
Molweight337.205
MonoisotopicMass336.043232
CLogP3.0147
CLogS-4.564
H Acceptors4
H Donors2
TotalSurfaceArea248.3
Relative PSA0.19734
PolarSurfaceArea58.2
Druglikeness0.4451
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantlow
Nasty Functionslimit! oxal-diamide
Shape Index0.63636
Fragments1
Non HAtoms22
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms2
Amides2
StereoCon

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