[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

Formula:C16H11NO6F2 Mutagenic:high Tumorigenic:none Reproductive Effective:none [2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate is a drug-like molecule.

MolName	[2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate
MolecularFormula	C16H11NO6F2
Smiles	O=C(COC(/C=C/c1ccco1)=O)Nc(cc1)cc(O2)c1OC2(F)F
InChI	InChI=1S/C16H11F2NO6/c17-16(18)24-12-5-3-10(8-13(12)25-16)19-14(20)9-23-15(21)6-4-11-2-1-7-22-11/h1-8H,9H2,(H,19,20)
InChIK	MMNBVTHPTFTCOU-UHFFFAOYSA-N
TotalMolweight	351.26
Molweight	351.26
MonoisotopicMass	351.055445
CLogP	3.6567
CLogS	-3.895
H Acceptors	7
H Donors	1
TotalSurfaceArea	249.54
Relative PSA	0.3272
PolarSurfaceArea	87
Druglikeness	-3.7413
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	5
Symmetricatoms	1
Amides	1
StereoCon

Click to Load Molecule:

1 - [2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate | 2 - [2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

Request More Details | [2-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-2-oxoethyl] (E)-3-(furan-2-yl)prop-2-enoate

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments