4-(2,4-dichlorophenoxy)-N'-[(E)-3-(4-fluorophenyl)prop-2-enoyl]butanehydrazide

Formula:C19H17N2O3Cl2F Mutagenic:high Tumorigenic:high Reproductive Effective:high 4-(2,4-dichlorophenoxy)-N'-[(E)-3-(4-fluorophenyl)prop-2-enoyl]butanehydrazide is a drug-like molecule.

MolName4-(2,4-dichlorophenoxy)-N'-[(E)-3-(4-fluorophenyl)prop-2-enoyl]butanehydrazide
MolecularFormulaC19H17N2O3Cl2F
SmilesO=C(CCCOc(ccc(Cl)c1)c1Cl)NNC(/C=C/c(cc1)ccc1F)=O
InChIInChI=1S/C19H17Cl2FN2O3/c20-14-6-9-17(16(21)12-14)27-11-1-2-18(25)23-24-19(26)10-5-13-3-7-15(22)8-4-13/h3-10,12H,1-2,11H2,(H,23,25)(H,24,26)
InChIKUCHCWTNFXBHYQV-UHFFFAOYSA-N
TotalMolweight411.259
Molweight411.259
MonoisotopicMass410.060025
CLogP3.7433
CLogS-5.786
H Acceptors5
H Donors2
TotalSurfaceArea306.41
Relative PSA0.19255
PolarSurfaceArea67.43
Druglikeness-4.7424
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Nasty Functions
Shape Index0.74074
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond8
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms2
StereoCon

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