2-[(E)-2-(4-fluorophenyl)ethenyl]-5-(2-nitrophenyl)-1,3,4-oxadiazole

Formula:C16H10N3O3F Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-(2-nitrophenyl)-1,3,4-oxadiazole is a drug-like molecule.

MolName	2-[(E)-2-(4-fluorophenyl)ethenyl]-5-(2-nitrophenyl)-1,3,4-oxadiazole
MolecularFormula	C16H10N3O3F
Smiles	[O-][N+](c(cccc1)c1-c1nnc(/C=C/c(cc2)ccc2F)o1)=O
InChI	InChI=1S/C16H10FN3O3/c17-12-8-5-11(6-9-12)7-10-15-18-19-16(23-15)13-3-1-2-4-14(13)20(21)22/h1-10H
InChIK	UASXPFFSTDIXQN-UHFFFAOYSA-N
TotalMolweight	311.271
Molweight	311.271
MonoisotopicMass	311.07062
CLogP	2.7604
CLogS	-5.539
H Acceptors	6
TotalSurfaceArea	236.51
Relative PSA	0.28105
PolarSurfaceArea	84.74
Druglikeness	-6.1641
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.6087
Fragments	1
Non HAtoms	23
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-(2-nitrophenyl)-1,3,4-oxadiazole | 2 - 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-(2-nitrophenyl)-1,3,4-oxadiazole

Request More Details | 2-[(E)-2-(4-fluorophenyl)ethenyl]-5-(2-nitrophenyl)-1,3,4-oxadiazole

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments