N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-2-(2,4-dichlorophenoxy)acetamide

Formula:C19H13N2O3BrCl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high N-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-2-(2,4-dichlorophenoxy)acetamide is not a drug-like molecule.

MolNameN-[(Z)-[5-(4-bromophenyl)furan-2-yl]methylideneamino]-2-(2,4-dichlorophenoxy)acetamide
MolecularFormulaC19H13N2O3BrCl2
SmilesO=C(COc(ccc(Cl)c1)c1Cl)N/N=C\c1ccc(-c(cc2)ccc2Br)o1
InChIInChI=1S/C19H13BrCl2N2O3/c20-13-3-1-12(2-4-13)17-8-6-15(27-17)10-23-24-19(25)11-26-18-7-5-14(21)9-16(18)22/h1-10H,11H2,(H,24,25)
InChIKZBEUEOJQQVFSHO-UHFFFAOYSA-N
TotalMolweight468.133
Molweight468.133
MonoisotopicMass465.948658
CLogP5.6526
CLogS-7.267
H Acceptors5
H Donors1
TotalSurfaceArea309.67
Relative PSA0.19414
PolarSurfaceArea63.83
Druglikeness4.6437
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.7037
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms2
Symmetricatoms2
StereoCon

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