2-[4-[(E)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl]phenoxy]acetamide

Formula:C20H13N3O2Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[4-[(E)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl]phenoxy]acetamide is a drug-like molecule.

MolName	2-[4-[(E)-2-cyano-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]ethenyl]phenoxy]acetamide
MolecularFormula	C20H13N3O2Cl2S
Smiles	NC(COc1ccc(/C=C(/c2nc(-c(cc3)cc(Cl)c3Cl)cs2)\C#N)cc1)=O
InChI	InChI=1S/C20H13Cl2N3O2S/c21-16-6-3-13(8-17(16)22)18-11-28-20(25-18)14(9-23)7-12-1-4-15(5-2-12)27-10-19(24)26/h1-8,11H,10H2,(H2,24,26)
InChIK	HFQCDUSLTWNENG-UHFFFAOYSA-N
TotalMolweight	430.314
Molweight	430.314
MonoisotopicMass	429.010551
CLogP	3.7871
CLogS	-5.778
H Acceptors	5
H Donors	1
TotalSurfaceArea	314.77
Relative PSA	0.26432
PolarSurfaceArea	117.24
Druglikeness	-1.0902
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64286
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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