N-[(Z)-3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C22H17N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(Z)-3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C22H17N3O4
Smiles	[O-][N+](c1ccc(/C=C(/C(Nc2ccccc2)=O)\NC(c2ccccc2)=O)cc1)=O
InChI	InChI=1S/C22H17N3O4/c26-21(17-7-3-1-4-8-17)24-20(22(27)23-18-9-5-2-6-10-18)15-16-11-13-19(14-12-16)25(28)29/h1-15H,(H,23,27)(H,24,26)
InChIK	AXVJTLGISAXJCZ-UHFFFAOYSA-N
TotalMolweight	387.394
Molweight	387.394
MonoisotopicMass	387.121907
CLogP	3.5022
CLogS	-5.333
H Acceptors	7
H Donors	2
TotalSurfaceArea	299.58
Relative PSA	0.2651
PolarSurfaceArea	104.02
Druglikeness	-2.1178
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	6
Amides	2
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - N-[(Z)-3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide | 2 - N-[(Z)-3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

Request More Details | N-[(Z)-3-anilino-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments