(E)-1-(4-bromophenyl)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-en-1-one

Formula:C19H11NO4BrCl Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-1-(4-bromophenyl)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-(4-bromophenyl)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-en-1-one
MolecularFormula	C19H11NO4BrCl
Smiles	[O-][N+](c(cc1)cc(Cl)c1-c1ccc(/C=C/C(c(cc2)ccc2Br)=O)o1)=O
InChI	InChI=1S/C19H11BrClNO4/c20-13-3-1-12(2-4-13)18(23)9-6-15-7-10-19(26-15)16-8-5-14(22(24)25)11-17(16)21/h1-11H
InChIK	OVDDNJCFQQDCSQ-UHFFFAOYSA-N
TotalMolweight	432.656
Molweight	432.656
MonoisotopicMass	430.955997
CLogP	4.6523
CLogS	-7.33
H Acceptors	5
TotalSurfaceArea	284.44
Relative PSA	0.2024
PolarSurfaceArea	76.03
Druglikeness	-5.0316
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.65385
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	2
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - (E)-1-(4-bromophenyl)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-en-1-one | 2 - (E)-1-(4-bromophenyl)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-en-1-one

Request More Details | (E)-1-(4-bromophenyl)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]prop-2-en-1-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments