(E)-N'-[2-(2,4-dibromophenoxy)acetyl]-3-thiophen-2-ylprop-2-enehydrazide

Formula:C15H12N2O3Br2S Mutagenic:high Tumorigenic:none Reproductive Effective:high (E)-N'-[2-(2,4-dibromophenoxy)acetyl]-3-thiophen-2-ylprop-2-enehydrazide is a drug-like molecule.

MolName(E)-N'-[2-(2,4-dibromophenoxy)acetyl]-3-thiophen-2-ylprop-2-enehydrazide
MolecularFormulaC15H12N2O3Br2S
SmilesO=C(COc(ccc(Br)c1)c1Br)NNC(/C=C/c1cccs1)=O
InChIInChI=1S/C15H12Br2N2O3S/c16-10-3-5-13(12(17)8-10)22-9-15(21)19-18-14(20)6-4-11-2-1-7-23-11/h1-8H,9H2,(H,18,20)(H,19,21)
InChIKIQLDZDLQZUXNDY-UHFFFAOYSA-N
TotalMolweight460.145
Molweight460.145
MonoisotopicMass457.893535
CLogP2.8387
CLogS-5.138
H Acceptors5
H Donors2
TotalSurfaceArea274.9
Relative PSA0.28869
PolarSurfaceArea95.67
Druglikeness0.66048
Mutagenichigh
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.69565
Fragments1
Non HAtoms23
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms2
StereoCon

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