(2E)-2-[[4-(1,3-dioxoisoindol-2-yl)phenyl]methylidene]-1,3-thiazolidine-4-carboxylic acid

Formula:C19H14N2O4S Mutagenic:high Tumorigenic:high Reproductive Effective:none (2E)-2-[[4-(1,3-dioxoisoindol-2-yl)phenyl]methylidene]-1,3-thiazolidine-4-carboxylic acid is a drug-like molecule.

MolName	(2E)-2-[[4-(1,3-dioxoisoindol-2-yl)phenyl]methylidene]-1,3-thiazolidine-4-carboxylic acid
MolecularFormula	C19H14N2O4S
Smiles	OC(C(CS1)N/C1=C\c(cc1)ccc1N(C(c1c2cccc1)=O)C2=O)=O
InChI	InChI=1S/C19H14N2O4S/c22-17-13-3-1-2-4-14(13)18(23)21(17)12-7-5-11(6-8-12)9-16-20-15(10-26-16)19(24)25/h1-9,15,20H,10H2,(H,24,25)/t15-/m1/s1
InChIK	SOFHKMSFBFBXPX-OAHLLOKOSA-N
TotalMolweight	366.396
Molweight	366.396
MonoisotopicMass	366.067428
CLogP	0.1117
CLogS	-4.707
H Acceptors	6
H Donors	2
TotalSurfaceArea	255.84
Relative PSA	0.33114
PolarSurfaceArea	112.01
Druglikeness	3.1019
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.57692
Fragments	1
Non HAtoms	26
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	7
Amides	1
BasicNitrogens	1
AcidicOxygens	1
StereoCon	racemate

Click to Load Molecule:

1 - (2E)-2-[[4-(1,3-dioxoisoindol-2-yl)phenyl]methylidene]-1,3-thiazolidine-4-carboxylic acid | 2 - (2E)-2-[[4-(1,3-dioxoisoindol-2-yl)phenyl]methylidene]-1,3-thiazolidine-4-carboxylic acid

Request More Details | (2E)-2-[[4-(1,3-dioxoisoindol-2-yl)phenyl]methylidene]-1,3-thiazolidine-4-carboxylic acid

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments