N-[(Z)-1-(1H-benzimidazol-2-yl)-2-(4-bromophenyl)ethenyl]furan-2-carboxamide

Formula:C20H14N3O2Br Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-1-(1H-benzimidazol-2-yl)-2-(4-bromophenyl)ethenyl]furan-2-carboxamide is a drug-like molecule.

MolName	N-[(Z)-1-(1H-benzimidazol-2-yl)-2-(4-bromophenyl)ethenyl]furan-2-carboxamide
MolecularFormula	C20H14N3O2Br
Smiles	O=C(c1ccco1)N/C(/c1nc(cccc2)c2[nH]1)=C\c(cc1)ccc1Br
InChI	InChI=1S/C20H14BrN3O2/c21-14-9-7-13(8-10-14)12-17(24-20(25)18-6-3-11-26-18)19-22-15-4-1-2-5-16(15)23-19/h1-12H,(H,22,23)(H,24,25)
InChIK	WAJNGSGMCOPHFS-UHFFFAOYSA-N
TotalMolweight	408.254
Molweight	408.254
MonoisotopicMass	407.026938
CLogP	4.0187
CLogS	-4.74
H Acceptors	5
H Donors	2
TotalSurfaceArea	277.95
Relative PSA	0.22871
PolarSurfaceArea	70.92
Druglikeness	0.48808
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46154
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	20
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

Click to Load Molecule:

1 - N-[(Z)-1-(1H-benzimidazol-2-yl)-2-(4-bromophenyl)ethenyl]furan-2-carboxamide | 2 - N-[(Z)-1-(1H-benzimidazol-2-yl)-2-(4-bromophenyl)ethenyl]furan-2-carboxamide

Request More Details | N-[(Z)-1-(1H-benzimidazol-2-yl)-2-(4-bromophenyl)ethenyl]furan-2-carboxamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments