C19H20N2O4 | Cheminformatics

methyl 4-[2-(2,2-diphenylacetyl)hydrazinyl]-4-oxobutanoate

Formula:C19H20N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none methyl 4-[2-(2,2-diphenylacetyl)hydrazinyl]-4-oxobutanoate is a drug-like molecule.

MolNamemethyl 4-[2-(2,2-diphenylacetyl)hydrazinyl]-4-oxobutanoate
MolecularFormulaC19H20N2O4
SmilesCOC(CCC(NNC(C(c1ccccc1)c1ccccc1)=O)=O)=O
InChIInChI=1S/C19H20N2O4/c1-25-17(23)13-12-16(22)20-21-19(24)18(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,18H,12-13H2,1H3,(H,20,22)(H,21,24)
InChIKDANMIXGVNOHPCU-UHFFFAOYSA-N
TotalMolweight340.378
Molweight340.378
MonoisotopicMass340.142308
CLogP1.7599
CLogS-3.397
H Acceptors6
H Donors2
TotalSurfaceArea271.47
Relative PSA0.26537
PolarSurfaceArea84.5
Druglikeness-6.2608
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.56
Fragments1
Non HAtoms25
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Symmetricatoms8
StereoCon

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