4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]butanamide

Formula:C22H19N3O2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high 4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]butanamide is not a drug-like molecule.

MolName	4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]butanamide
MolecularFormula	C22H19N3O2Cl2
Smiles	O=C(CCCOc(ccc(Cl)c1)c1Cl)N/N=C(\c1ccccc1)/c1ncccc1
InChI	InChI=1S/C22H19Cl2N3O2/c23-17-11-12-20(18(24)15-17)29-14-6-10-21(28)26-27-22(16-7-2-1-3-8-16)19-9-4-5-13-25-19/h1-5,7-9,11-13,15H,6,10,14H2,(H,26,28)
InChIK	STMVRQJVYVSEOY-UHFFFAOYSA-N
TotalMolweight	428.318
Molweight	428.318
MonoisotopicMass	427.085431
CLogP	5.1471
CLogS	-6.518
H Acceptors	5
H Donors	1
TotalSurfaceArea	325.84
Relative PSA	0.17487
PolarSurfaceArea	63.58
Druglikeness	-0.87543
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	acyl-hydrazone
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

Click to Load Molecule:

1 - 4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]butanamide | 2 - 4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]butanamide

Request More Details | 4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]butanamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments