[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

Formula:C15H11N2O6F Mutagenic:high Tumorigenic:none Reproductive Effective:none [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-(4-fluoro-3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C15H11N2O6F
Smiles	[O-][N+](c(cc(cc1)NC(COC(/C=C/c2ccco2)=O)=O)c1F)=O
InChI	InChI=1S/C15H11FN2O6/c16-12-5-3-10(8-13(12)18(21)22)17-14(19)9-24-15(20)6-4-11-2-1-7-23-11/h1-8H,9H2,(H,17,19)
InChIK	CMOVVOHUQRXNOR-UHFFFAOYSA-N
TotalMolweight	334.258
Molweight	334.258
MonoisotopicMass	334.060116
CLogP	1.0621
CLogS	-3.857
H Acceptors	8
H Donors	1
TotalSurfaceArea	249.95
Relative PSA	0.36835
PolarSurfaceArea	114.36
Druglikeness	-6.1179
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.625
Fragments	1
Non HAtoms	24
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	3
Amides	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate | 2 - [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

Request More Details | [2-(4-fluoro-3-nitroanilino)-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments