(E)-N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-(4-chlorophenyl)prop-2-enamide

Formula:C22H15N3OCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-(4-chlorophenyl)prop-2-enamide is not a drug-like molecule.

MolName	(E)-N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-(4-chlorophenyl)prop-2-enamide
MolecularFormula	C22H15N3OCl2
Smiles	O=C(/C=C/c(cc1)ccc1Cl)Nc(cc1)cc(-c2nc(cccc3)c3[nH]2)c1Cl
InChI	InChI=1S/C22H15Cl2N3O/c23-15-8-5-14(6-9-15)7-12-21(28)25-16-10-11-18(24)17(13-16)22-26-19-3-1-2-4-20(19)27-22/h1-13H,(H,25,28)(H,26,27)
InChIK	BZQQIHYFKWQZGQ-UHFFFAOYSA-N
TotalMolweight	408.287
Molweight	408.287
MonoisotopicMass	407.059216
CLogP	5.5909
CLogS	-7.326
H Acceptors	4
H Donors	2
TotalSurfaceArea	302.26
Relative PSA	0.16363
PolarSurfaceArea	57.78
Druglikeness	-0.1016
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.60714
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - (E)-N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-(4-chlorophenyl)prop-2-enamide | 2 - (E)-N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-(4-chlorophenyl)prop-2-enamide

Request More Details | (E)-N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-(4-chlorophenyl)prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments