N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide

Formula:C16H12N6O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide is a drug-like molecule.

MolNameN-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
MolecularFormulaC16H12N6O2Cl2
SmilesO=C(COc(cc1)ccc1-n1nnnc1)N/N=C\c(ccc(Cl)c1)c1Cl
InChIInChI=1S/C16H12Cl2N6O2/c17-12-2-1-11(15(18)7-12)8-19-21-16(25)9-26-14-5-3-13(4-6-14)24-10-20-22-23-24/h1-8,10H,9H2,(H,21,25)
InChIKLMHHWWXENLFBHK-UHFFFAOYSA-N
TotalMolweight391.217
Molweight391.217
MonoisotopicMass390.039878
CLogP2.8871
CLogS-5.272
H Acceptors8
H Donors1
TotalSurfaceArea286.83
Relative PSA0.2991
PolarSurfaceArea94.29
Druglikeness3.1521
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.69231
Fragments1
Non HAtoms26
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms2
Symmetricatoms2
Aromatic Nitrogens4
StereoCon

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