C22H20N2O4 | Cheminformatics

N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(furan-2-ylmethyl)furan-2-carboxamide

Formula:C22H20N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(furan-2-ylmethyl)furan-2-carboxamide is a drug-like molecule.

MolNameN-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(furan-2-ylmethyl)furan-2-carboxamide
MolecularFormulaC22H20N2O4
SmilesCc(cc1)c(C)c(N2)c1C=C(CN(Cc1ccco1)C(c1ccco1)=O)C2=O
InChIInChI=1S/C22H20N2O4/c1-14-7-8-16-11-17(21(25)23-20(16)15(14)2)12-24(13-18-5-3-9-27-18)22(26)19-6-4-10-28-19/h3-11H,12-13H2,1-2H3,(H,23,25)
InChIKIOAZDHYVFGLCNR-UHFFFAOYSA-N
TotalMolweight376.411
Molweight376.411
MonoisotopicMass376.142308
CLogP2.6646
CLogS-4.486
H Acceptors6
H Donors1
TotalSurfaceArea292.67
Relative PSA0.23682
PolarSurfaceArea75.69
Druglikeness5.2688
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.46429
Fragments1
Non HAtoms28
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms4
Amides2
StereoCon

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