(5E)-3-(furan-2-ylmethyl)-5-[[2-[(3-nitrophenyl)methoxy]phenyl]methylidene]-2-phenylimino-1,3-thiazolidin-4-one

Formula:C28H21N3O5S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5E)-3-(furan-2-ylmethyl)-5-[[2-[(3-nitrophenyl)methoxy]phenyl]methylidene]-2-phenylimino-1,3-thiazolidin-4-one is not a drug-like molecule.

MolName	(5E)-3-(furan-2-ylmethyl)-5-[[2-[(3-nitrophenyl)methoxy]phenyl]methylidene]-2-phenylimino-1,3-thiazolidin-4-one
MolecularFormula	C28H21N3O5S
Smiles	[O-][N+](c1cccc(COc2c(/C=C(\C(N3Cc4ccco4)=O)/S/C3=N\c3ccccc3)cccc2)c1)=O
InChI	InChI=1S/C28H21N3O5S/c32-27-26(37-28(29-22-10-2-1-3-11-22)30(27)18-24-13-7-15-35-24)17-21-9-4-5-14-25(21)36-19-20-8-6-12-23(16-20)31(33)34/h1-17H,18-19H2
InChIK	TYBUSQKBJSSWFY-UHFFFAOYSA-N
TotalMolweight	511.557
Molweight	511.557
MonoisotopicMass	511.120192
CLogP	4.2161
CLogS	-6.811
H Acceptors	8
TotalSurfaceArea	383.14
Relative PSA	0.26131
PolarSurfaceArea	126.16
Druglikeness	-0.92171
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.48649
Fragments	1
Non HAtoms	37
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	5
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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