2-[2-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenoxy]-N-(3,4-dichlorophenyl)acetamide

Formula:C24H15N3O2Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[2-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenoxy]-N-(3,4-dichlorophenyl)acetamide is not a drug-like molecule.

MolName	2-[2-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenoxy]-N-(3,4-dichlorophenyl)acetamide
MolecularFormula	C24H15N3O2Cl2S
Smiles	N#C/C(/c1nc(cccc2)c2s1)=C\c(cccc1)c1OCC(Nc(cc1)cc(Cl)c1Cl)=O
InChI	InChI=1S/C24H15Cl2N3O2S/c25-18-10-9-17(12-19(18)26)28-23(30)14-31-21-7-3-1-5-15(21)11-16(13-27)24-29-20-6-2-4-8-22(20)32-24/h1-12H,14H2,(H,28,30)
InChIK	WVGUHENAEMMTDQ-UHFFFAOYSA-N
TotalMolweight	480.374
Molweight	480.374
MonoisotopicMass	479.026201
CLogP	5.2742
CLogS	-6.657
H Acceptors	5
H Donors	1
TotalSurfaceArea	352.31
Relative PSA	0.22534
PolarSurfaceArea	103.25
Druglikeness	-1.6033
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5625
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Amides	1
Aromatic Nitrogens	1
StereoCon

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