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

Formula:C17H10NO5Cl Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-1-(furan-2-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-1-(furan-2-yl)prop-2-en-1-one
MolecularFormula	C17H10NO5Cl
Smiles	[O-][N+](c(cc1)cc(Cl)c1-c1ccc(/C=C/C(c2ccco2)=O)o1)=O
InChI	InChI=1S/C17H10ClNO5/c18-14-10-11(19(21)22)3-6-13(14)16-8-5-12(24-16)4-7-15(20)17-2-1-9-23-17/h1-10H
InChIK	YMVZXXNGKZKIAR-UHFFFAOYSA-N
TotalMolweight	343.721
Molweight	343.721
MonoisotopicMass	343.024751
CLogP	3.1158
CLogS	-6.178
H Acceptors	6
TotalSurfaceArea	255.5
Relative PSA	0.28055
PolarSurfaceArea	89.17
Druglikeness	-3.2326
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

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

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

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments