(2S)-3-(4-chlorophenyl)sulfonyl-2-(2,5-dimethoxyphenyl)-1,3-thiazolidine

Formula:C17H18NO4ClS2 Mutagenic:low Tumorigenic:none Reproductive Effective:none (2S)-3-(4-chlorophenyl)sulfonyl-2-(2,5-dimethoxyphenyl)-1,3-thiazolidine is a drug-like molecule.

MolName	(2S)-3-(4-chlorophenyl)sulfonyl-2-(2,5-dimethoxyphenyl)-1,3-thiazolidine
MolecularFormula	C17H18NO4ClS2
Smiles	COc(cc1)cc([C@@H]2SCCN2S(c(cc2)ccc2Cl)(=O)=O)c1OC
InChI	InChI=1S/C17H18ClNO4S2/c1-22-13-5-8-16(23-2)15(11-13)17-19(9-10-24-17)25(20,21)14-6-3-12(18)4-7-14/h3-8,11,17H,9-10H2,1-2H3/t17-/m0/s1
InChIK	VCJQEOCYVAOMSJ-KRWDZBQOSA-N
TotalMolweight	399.918
Molweight	399.918
MonoisotopicMass	399.036576
CLogP	3.1589
CLogS	-3.339
H Acceptors	5
TotalSurfaceArea	275.85
Relative PSA	0.25238
PolarSurfaceArea	89.52
Druglikeness	4.6893
Mutagenic	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	1
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	9
Symmetricatoms	3
Amides	1
StereoCon	this enantiomer

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