4-[[(Z)-3-(3,4-dichlorophenyl)-3-oxoprop-1-enyl]amino]-N-pyrimidin-2-ylbenzenesulfonamide

Formula:C19H14N4O3Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[[(Z)-3-(3,4-dichlorophenyl)-3-oxoprop-1-enyl]amino]-N-pyrimidin-2-ylbenzenesulfonamide is a drug-like molecule.

MolName	4-[[(Z)-3-(3,4-dichlorophenyl)-3-oxoprop-1-enyl]amino]-N-pyrimidin-2-ylbenzenesulfonamide
MolecularFormula	C19H14N4O3Cl2S
Smiles	O=C(/C=C\Nc(cc1)ccc1S(Nc1ncccn1)(=O)=O)c(cc1)cc(Cl)c1Cl
InChI	InChI=1S/C19H14Cl2N4O3S/c20-16-7-2-13(12-17(16)21)18(26)8-11-22-14-3-5-15(6-4-14)29(27,28)25-19-23-9-1-10-24-19/h1-12,22H,(H,23,24,25)
InChIK	YYWXPSKNXWFWGG-UHFFFAOYSA-N
TotalMolweight	449.317
Molweight	449.317
MonoisotopicMass	448.016365
CLogP	2.7919
CLogS	-5.858
H Acceptors	7
H Donors	2
TotalSurfaceArea	316.89
Relative PSA	0.2729
PolarSurfaceArea	109.43
Druglikeness	4.3202
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.65517
Fragments	1
Non HAtoms	29
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	5
Amides	1
Aromatic Nitrogens	2
StereoCon

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