4-chloro-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]benzamide

Formula:C15H10N2O2ClF3S Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-chloro-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]benzamide is a drug-like molecule.

MolName	4-chloro-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]benzamide
MolecularFormula	C15H10N2O2ClF3S
Smiles	O=C(C/C(/C(F)(F)F)=N/NC(c(cc1)ccc1Cl)=O)c1cscc1
InChI	InChI=1S/C15H10ClF3N2O2S/c16-11-3-1-9(2-4-11)14(23)21-20-13(15(17,18)19)7-12(22)10-5-6-24-8-10/h1-6,8H,7H2,(H,21,23)
InChIK	LBBRBXPDHKCILK-UHFFFAOYSA-N
TotalMolweight	374.769
Molweight	374.769
MonoisotopicMass	374.010359
CLogP	3.87
CLogS	-5.649
H Acceptors	4
H Donors	1
TotalSurfaceArea	257.53
Relative PSA	0.26952
PolarSurfaceArea	86.77
Druglikeness	-7.1327
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone
Shape Index	0.58333
Fragments	1
Non HAtoms	24
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Symmetricatoms	4
StereoCon

Click to Load Molecule:

1 - 4-chloro-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]benzamide | 2 - 4-chloro-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]benzamide

Request More Details | 4-chloro-N-[(Z)-(1,1,1-trifluoro-4-oxo-4-thiophen-3-ylbutan-2-ylidene)amino]benzamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments