Name: Name:2-(5-chlorothiophen-2-yl)-1,3-thiazolidine-4-carboxylic acid, Mixture of diastereomers
Brand: Angene
SKU: AG01AADF
Rating: 90 (10 reviews)

2-(5-chlorothiophen-2-yl)-1,3-thiazolidine-4-carboxylic acid, Mixture of diastereomers

CAS No.:

1218116-94-9

Catalog Number:

AG01AADF

Molecular Formula:

C8H8ClNO2S2

Molecular Weight:

249.7376

Catalog Number:

AG01AADF

Chemical Name:

2-(5-chlorothiophen-2-yl)-1,3-thiazolidine-4-carboxylic acid, Mixture of diastereomers

CAS Number:

1218116-94-9

Molecular Formula:

C8H8ClNO2S2

Molecular Weight:

249.7376

MDL Number:

MFCD11186361

IUPAC Name:

2-(5-chlorothiophen-2-yl)-1,3-thiazolidine-4-carboxylic acid

InChI:

InChI=1S/C8H8ClNO2S2/c9-6-2-1-5(14-6)7-10-4(3-13-7)8(11)12/h1-2,4,7,10H,3H2,(H,11,12)

InChI Key:

IKBXTCUEVOKTDZ-UHFFFAOYSA-N

SMILES:

OC(=O)C1CSC(N1)c1ccc(s1)Cl

Complexity:

241

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

248.968g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.727g/mol

Monoisotopic Mass:

248.968g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

103A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1