2,2,2-trifluoro-N-[(7E)-7-hydroxyimino-5,6-dihydrocyclopenta[f][1,3]benzodioxol-5-yl]acetamide

Formula:C12H9N2O4F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2,2,2-trifluoro-N-[(7E)-7-hydroxyimino-5,6-dihydrocyclopenta[f][1,3]benzodioxol-5-yl]acetamide is a drug-like molecule.

MolName	2,2,2-trifluoro-N-[(7E)-7-hydroxyimino-5,6-dihydrocyclopenta[f][1,3]benzodioxol-5-yl]acetamide
MolecularFormula	C12H9N2O4F3
Smiles	O/N=C(\CC1NC(C(F)(F)F)=O)/c2c1cc1OCOc1c2
InChI	InChI=1S/C12H9F3N2O4/c13-12(14,15)11(18)16-7-3-8(17-19)6-2-10-9(1-5(6)7)20-4-21-10/h1-2,7,19H,3-4H2,(H,16,18)/t7-/m0/s1
InChIK	VZPDHWQSJUAYNW-ZETCQYMHSA-N
TotalMolweight	302.207
Molweight	302.207
MonoisotopicMass	302.051442
CLogP	2.4251
CLogS	-4.171
H Acceptors	6
H Donors	2
TotalSurfaceArea	194.27
Relative PSA	0.35574
PolarSurfaceArea	80.15
Druglikeness	-25.441
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.47619
Fragments	1
Non HAtoms	21
NonCHAtoms	9
Electronegative Atoms	9
StereoCenters	1
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	7
Symmetricatoms	2
Amides	1
StereoCon	racemate

Click to Load Molecule:

1 - 2,2,2-trifluoro-N-[(7E)-7-hydroxyimino-5,6-dihydrocyclopenta[f][1,3]benzodioxol-5-yl]acetamide | 2 - 2,2,2-trifluoro-N-[(7E)-7-hydroxyimino-5,6-dihydrocyclopenta[f][1,3]benzodioxol-5-yl]acetamide

Request More Details | 2,2,2-trifluoro-N-[(7E)-7-hydroxyimino-5,6-dihydrocyclopenta[f][1,3]benzodioxol-5-yl]acetamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments