(E)-3-(4-chlorophenyl)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide

Formula:C20H19NO3Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-chlorophenyl)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide is a drug-like molecule.

MolName	(E)-3-(4-chlorophenyl)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide
MolecularFormula	C20H19NO3Cl2S
Smiles	O=C(/C=C/c(cc1)ccc1Cl)N(Cc1cccc(Cl)c1)C(CC1)CS1(=O)=O
InChI	InChI=1S/C20H19Cl2NO3S/c21-17-7-4-15(5-8-17)6-9-20(24)23(19-10-11-27(25,26)14-19)13-16-2-1-3-18(22)12-16/h1-9,12,19H,10-11,13-14H2/t19-/m0/s1
InChIK	XIKHECAFUGGGHJ-IBGZPJMESA-N
TotalMolweight	424.347
Molweight	424.347
MonoisotopicMass	423.046268
CLogP	3.6879
CLogS	-4.968
H Acceptors	4
TotalSurfaceArea	301.03
Relative PSA	0.15005
PolarSurfaceArea	62.83
Druglikeness	-0.09884
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51852
Fragments	1
Non HAtoms	27
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	3
Amides	1
StereoCon	racemate

Click to Load Molecule:

1 - (E)-3-(4-chlorophenyl)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide | 2 - (E)-3-(4-chlorophenyl)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide

Request More Details | (E)-3-(4-chlorophenyl)-N-[(3-chlorophenyl)methyl]-N-(1,1-dioxothiolan-3-yl)prop-2-enamide

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments