N-[(E)-1-(2-aminophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide

Formula:C16H16N4O2 Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(E)-1-(2-aminophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(E)-1-(2-aminophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C16H16N4O2
Smiles	Nc1c(/C=C(\C(NN)=O)/NC(c2ccccc2)=O)cccc1
InChI	InChI=1S/C16H16N4O2/c17-13-9-5-4-8-12(13)10-14(16(22)20-18)19-15(21)11-6-2-1-3-7-11/h1-10H,17-18H2,(H,19,21)(H,20,22)
InChIK	AAOZZYMRVMMYKA-UHFFFAOYSA-N
TotalMolweight	296.329
Molweight	296.329
MonoisotopicMass	296.127326
CLogP	0.9222
CLogS	-3.803
H Acceptors	6
H Donors	4
TotalSurfaceArea	233.19
Relative PSA	0.3411
PolarSurfaceArea	110.24
Druglikeness	-2.7755
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	hydrazine
Shape Index	0.54545
Fragments	1
Non HAtoms	22
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
Amides	1
Amines	1
Aromatic Amines	1
StereoCon

Click to Load Molecule:

1 - N-[(E)-1-(2-aminophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide | 2 - N-[(E)-1-(2-aminophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide

Request More Details | N-[(E)-1-(2-aminophenyl)-3-hydrazinyl-3-oxoprop-1-en-2-yl]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments