4-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide

Formula:C21H26N3O4FS Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide is a drug-like molecule.

MolName	4-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethoxy]-N-propan-2-ylbenzenesulfonamide
MolecularFormula	C21H26N3O4FS
Smiles	CC(C)NS(c(cc1)ccc1OCC(N(CC1)CCN1c(cc1)ccc1F)=O)(=O)=O
InChI	InChI=1S/C21H26FN3O4S/c1-16(2)23-30(27,28)20-9-7-19(8-10-20)29-15-21(26)25-13-11-24(12-14-25)18-5-3-17(22)4-6-18/h3-10,16,23H,11-15H2,1-2H3
InChIK	KIPHDUSMCHBAIA-UHFFFAOYSA-N
TotalMolweight	435.518
Molweight	435.518
MonoisotopicMass	435.162805
CLogP	2.5052
CLogS	-2.998
H Acceptors	7
H Donors	1
TotalSurfaceArea	320.08
Relative PSA	0.21926
PolarSurfaceArea	87.33
Druglikeness	6.8613
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	high
Nasty Functions
Shape Index	0.66667
Fragments	1
Non HAtoms	30
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	10
Symmetricatoms	8
Amides	2
Amines	1
Aromatic Amines	1
StereoCon

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