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Pidotimod Impurity D

CAT: 1299-RM-P136004-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-P136004-04Size:100 mg
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CAS Number
162148-15-4
Synonyms
(S) -3- ((R) -5-oxopyrrolidine-2-carbonyl) thiazolidine-4-carboxylic acid
Molecular Formula
C9H12N2O4S
Molecular Weight
244.27
Target Alternative Name
Pidotimod
Product Name Synonym
(S) -3- ((R) -5-oxopyrrolidine-2-carbonyl) thiazolidine-4-carboxylic acid

Chemical Information

(S)-3-((R)-5-Oxopyrrolidine-2-carbonyl)thiazolidine-4-carboxylic acid
CAS Number162148-15-4
PubChem CID7048518
IUPAC Name(4S)-3-[(2R)-5-oxopyrrolidine-2-carbonyl]-1,3-thiazolidine-4-carboxylic acid
Molecular FormulaC9H12N2O4S
Molecular Weight244.27
XLogP-0.7
Topological Polar Surface Area112
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity346
SMILES
C1CC(=O)N[C@H]1C(=O)N2CSC[C@@H]2C(=O)O
InChI
InChI=1S/C9H12N2O4S/c12-7-2-1-5(10-7)8(13)11-4-16-3-6(11)9(14)15/h5-6H,1-4H2,(H,10,12)(H,14,15)/t5-,6-/m1/s1
InChIKey
UUTKICFRNVKFRG-PHDIDXHHSA-N
Chemical Structure
2D Structure
2D structure of (S)-3-((R)-5-Oxopyrrolidine-2-carbonyl)thiazolidine-4-carboxylic acid
CAS: 162148-15-4
CID: 7048518
Formula: C9H12N2O4S
MW: 244.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight244.27
XLogP3-0.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass244.05177804
Monoisotopic Mass244.05177804
Topological Polar Surface Area112 Ų
Heavy Atom Count16
Formal Charge0
Complexity346
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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