(2Z)-2-[[3-chloro-5-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

Formula:C26H21N2O3ClS Mutagenic:none Tumorigenic:none Reproductive Effective:none (2Z)-2-[[3-chloro-5-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one is not a drug-like molecule.

MolName	(2Z)-2-[[3-chloro-5-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
MolecularFormula	C26H21N2O3ClS
Smiles	CCOc1cc(/C=C2\Sc3nc(cccc4)c4n3C2=O)cc(Cl)c1OCc1c(C)cccc1
InChI	InChI=1S/C26H21ClN2O3S/c1-3-31-22-13-17(12-19(27)24(22)32-15-18-9-5-4-8-16(18)2)14-23-25(30)29-21-11-7-6-10-20(21)28-26(29)33-23/h4-14H,3,15H2,1-2H3
InChIK	ASORHRWVZFHESM-UHFFFAOYSA-N
TotalMolweight	476.983
Molweight	476.983
MonoisotopicMass	476.09614
CLogP	6.1405
CLogS	-6.874
H Acceptors	5
TotalSurfaceArea	349.25
Relative PSA	0.19576
PolarSurfaceArea	78.65
Druglikeness	1.8124
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	7
Aromatic Nitrogens	2
StereoCon

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1 - (2Z)-2-[[3-chloro-5-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one | 2 - (2Z)-2-[[3-chloro-5-ethoxy-4-[(2-methylphenyl)methoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

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