4-chloro-3-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid

Formula:C15H8NO5ClS Mutagenic:high Tumorigenic:high Reproductive Effective:none 4-chloro-3-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid is a drug-like molecule.

MolName	4-chloro-3-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid
MolecularFormula	C15H8NO5ClS
Smiles	OC(c(cc1)cc(-c2ccc(/C=C(/C(N3)=O)\SC3=O)o2)c1Cl)=O
InChI	InChI=1S/C15H8ClNO5S/c16-10-3-1-7(14(19)20)5-9(10)11-4-2-8(22-11)6-12-13(18)17-15(21)23-12/h1-6H,(H,19,20)(H,17,18,21)
InChIK	VAZUZWQSGGSYOE-UHFFFAOYSA-N
TotalMolweight	349.75
Molweight	349.75
MonoisotopicMass	348.981171
CLogP	2.5194
CLogS	-5.358
H Acceptors	6
H Donors	2
TotalSurfaceArea	237.89
Relative PSA	0.40052
PolarSurfaceArea	121.91
Druglikeness	3.9727
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! methylene-thiazolidine-2,4-dione
Shape Index	0.56522
Fragments	1
Non HAtoms	23
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Amides	1
AcidicOxygens	1
StereoCon

Click to Load Molecule:

1 - 4-chloro-3-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid | 2 - 4-chloro-3-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid

Request More Details | 4-chloro-3-[5-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl]benzoic acid

SKU	Product Name	Product Unit	Qty	Supplier Email

User Name
User Email
Additional Comments