(E)-3-(2-chloro-6-fluorophenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one

Formula:C19H17N2OCl2F Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(2-chloro-6-fluorophenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(2-chloro-6-fluorophenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one
MolecularFormula	C19H17N2OCl2F
Smiles	O=C(/C=C/c(c(F)ccc1)c1Cl)N(CC1)CCN1c1cc(Cl)ccc1
InChI	InChI=1S/C19H17Cl2FN2O/c20-14-3-1-4-15(13-14)23-9-11-24(12-10-23)19(25)8-7-16-17(21)5-2-6-18(16)22/h1-8,13H,9-12H2
InChIK	NJPWZMCHBJHUBO-UHFFFAOYSA-N
TotalMolweight	379.261
Molweight	379.261
MonoisotopicMass	378.070195
CLogP	4.5805
CLogS	-4.829
H Acceptors	3
TotalSurfaceArea	276.6
Relative PSA	0.072813
PolarSurfaceArea	23.55
Druglikeness	4.17
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	2
Amides	1
Amines	1
Aromatic Amines	1
StereoCon

Click to Load Molecule:

1 - (E)-3-(2-chloro-6-fluorophenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one | 2 - (E)-3-(2-chloro-6-fluorophenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one

Request More Details | (E)-3-(2-chloro-6-fluorophenyl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments