(5Z)-5-[[2-[(2-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one

Formula:C20H13N4O4ClS2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[[2-[(2-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one is a drug-like molecule.

MolName	(5Z)-5-[[2-[(2-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one
MolecularFormula	C20H13N4O4ClS2
Smiles	N=C(N(C1=O)c2nccs2)S/C1=C\c(cc(cc1)[N+]([O-])=O)c1OCc(cccc1)c1Cl
InChI	InChI=1S/C20H13ClN4O4S2/c21-15-4-2-1-3-12(15)11-29-16-6-5-14(25(27)28)9-13(16)10-17-18(26)24(19(22)31-17)20-23-7-8-30-20/h1-10,22H,11H2
InChIK	ZDWDQLSNCDQUGM-UHFFFAOYSA-N
TotalMolweight	472.932
Molweight	472.932
MonoisotopicMass	472.006673
CLogP	3.4963
CLogS	-6.082
H Acceptors	8
H Donors	1
TotalSurfaceArea	327.39
Relative PSA	0.3709
PolarSurfaceArea	165.64
Druglikeness	-1.1523
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.48387
Fragments	1
Non HAtoms	31
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	4
Amides	1
Aromatic Nitrogens	1
AcidicOxygens	1
StereoCon

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1 - (5Z)-5-[[2-[(2-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one | 2 - (5Z)-5-[[2-[(2-chlorophenyl)methoxy]-5-nitrophenyl]methylidene]-2-imino-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-4-one

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