Home Carboxys 2-(2-phenylethyl)-1,3-thiazolidine-4-carboxylic acid

2-(2-phenylethyl)-1,3-thiazolidine-4-carboxylic acid

CAS No.:
65469-04-7
Catalog Number:
AG00IVMK
Molecular Formula:
C12H15NO2S
Molecular Weight:
237.3180
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Product Description
Catalog Number:
AG00IVMK
Chemical Name:
2-(2-phenylethyl)-1,3-thiazolidine-4-carboxylic acid
CAS Number:
65469-04-7
Molecular Formula:
C12H15NO2S
Molecular Weight:
237.3180
MDL Number:
MFCD01622693
IUPAC Name:
2-(2-phenylethyl)-1,3-thiazolidine-4-carboxylic acid
InChI:
InChI=1S/C12H15NO2S/c14-12(15)10-8-16-11(13-10)7-6-9-4-2-1-3-5-9/h1-5,10-11,13H,6-8H2,(H,14,15)
InChI Key:
OFMACPNNROAUSV-UHFFFAOYSA-N
SMILES:
OC(=O)C1CSC(N1)CCc1ccccc1
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.082g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.317g/mol
Monoisotopic Mass:
237.082g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties