(E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide

Formula:C22H16N4O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide
MolecularFormula	C22H16N4O3
Smiles	[O-][N+](c1c(/C=C/C(Nc(cccc2)c2-c2nc(cccc3)c3[nH]2)=O)cccc1)=O
InChI	InChI=1S/C22H16N4O3/c27-21(14-13-15-7-1-6-12-20(15)26(28)29)23-17-9-3-2-8-16(17)22-24-18-10-4-5-11-19(18)25-22/h1-14H,(H,23,27)(H,24,25)
InChIK	DETFWIIVSODEGP-UHFFFAOYSA-N
TotalMolweight	384.394
Molweight	384.394
MonoisotopicMass	384.122241
CLogP	3.2869
CLogS	-6.314
H Acceptors	7
H Donors	2
TotalSurfaceArea	295.09
Relative PSA	0.2707
PolarSurfaceArea	103.6
Druglikeness	-5.2479
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Amides	1
Aromatic Nitrogens	2
BasicNitrogens	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide | 2 - (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide

Request More Details | (E)-N-[2-(1H-benzimidazol-2-yl)phenyl]-3-(2-nitrophenyl)prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments