2-chloro-N-[2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl]benzamide

Formula:C16H13N4O5Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-chloro-N-[2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl]benzamide is a drug-like molecule.

MolName2-chloro-N-[2-[2-(4-nitrobenzoyl)hydrazinyl]-2-oxoethyl]benzamide
MolecularFormulaC16H13N4O5Cl
Smiles[O-][N+](c(cc1)ccc1C(NNC(CNC(c(cccc1)c1Cl)=O)=O)=O)=O
InChIInChI=1S/C16H13ClN4O5/c17-13-4-2-1-3-12(13)16(24)18-9-14(22)19-20-15(23)10-5-7-11(8-6-10)21(25)26/h1-8H,9H2,(H,18,24)(H,19,22)(H,20,23)
InChIKGLXZNAMKAKYUMI-UHFFFAOYSA-N
TotalMolweight376.755
Molweight376.755
MonoisotopicMass376.057448
CLogP0.3857
CLogS-4.273
H Acceptors9
H Donors3
TotalSurfaceArea273.5
Relative PSA0.37996
PolarSurfaceArea133.12
Druglikeness-2.0943
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsaromatic nitro
Shape Index0.65385
Fragments1
Non HAtoms26
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond6
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms2
Amides1
AcidicOxygens1
StereoCon

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