N-(2,4-dichlorophenyl)-N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]butanediamide

Formula:C25H21N3O2Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-(2,4-dichlorophenyl)-N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]butanediamide is not a drug-like molecule.

MolName	N-(2,4-dichlorophenyl)-N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]butanediamide
MolecularFormula	C25H21N3O2Cl2
Smiles	O=C(CCC(N/N=C(\C=C\c1ccccc1)/c1ccccc1)=O)Nc(ccc(Cl)c1)c1Cl
InChI	InChI=1S/C25H21Cl2N3O2/c26-20-12-14-23(21(27)17-20)28-24(31)15-16-25(32)30-29-22(19-9-5-2-6-10-19)13-11-18-7-3-1-4-8-18/h1-14,17H,15-16H2,(H,28,31)(H,30,32)
InChIK	WPPPNSVDZXBBGK-UHFFFAOYSA-N
TotalMolweight	466.367
Molweight	466.367
MonoisotopicMass	465.101081
CLogP	5.9756
CLogS	-7.437
H Acceptors	5
H Donors	2
TotalSurfaceArea	359.03
Relative PSA	0.16854
PolarSurfaceArea	70.56
Druglikeness	2.7791
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone
Shape Index	0.59375
Fragments	1
Non HAtoms	32
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
Amides	1
StereoCon

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1 - N-(2,4-dichlorophenyl)-N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]butanediamide | 2 - N-(2,4-dichlorophenyl)-N'-[(E)-[(E)-1,3-diphenylprop-2-enylidene]amino]butanediamide

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