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10574-69-3,MFCD00086924
Catalog No.:AA003IW8
10574-69-3 | 3-Benzylrhodanine
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1g
95%
in stock  
$29.00   $20.00
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5g
95%
in stock  
$86.00   $60.00
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25g
95%
in stock  
$235.00   $164.00
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  • Technical Information
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  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IW8
Chemical Name:
3-Benzylrhodanine
CAS Number:
10574-69-3
Molecular Formula:
C10H9NOS2
Molecular Weight:
223.3146
MDL Number:
MFCD00086924
IUPAC Name:
3-benzyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C10H9NOS2/c12-9-7-14-10(13)11(9)6-8-4-2-1-3-5-8/h1-5H,6-7H2
InChI Key:
ZFHVUMCTGGAWBM-UHFFFAOYSA-N
SMILES:
O=C1CSC(=S)N1Cc1ccccc1
NSC Number:
142477
Properties
Computed Properties
 
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.013g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.308g/mol
Monoisotopic Mass:
223.013g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
3-Benzylrhodanine 
10574-69-3 
MLS002920556 
3-(Phenylmethyl)-2-thioxo-4-thiazolidinone 
ZFHVUMCTGGAWBM-UHFFFAOYSA-N 
3-benzyl-2-sulfanylidene-1,3-thiazolidin-4-one 
3-Benzyl-2-thioxo-4-thiazolidinone 
3-Benzyl-2-thioxo-thiazolidin-4-one 
4-Thiazolidinone,3-(phenylmethyl)-2-thioxo- 
Benzyl Rhodanine 
NSC142477 
benzylthioxothiazolanone 
N-Benzylrhodanine 
Maybridge3_004257 
3-(Phenylmethyl)rhodanide 
ACMC-2098hj 
C10H9NOS2 
AC1L3Z00 
CHEMBL224367 
SCHEMBL1520611 
CTK4A4093 
DTXSID60147309 
JS-129C 
Rhodanine, 3-benzyl- 
HMS1443B11 
ALBB-025043 
ZINC1041008 
ZX-AN023557 
ZX-AT009778 
8248AC 
ANW-15269 
BBL003962 
MFCD00086924 
SBB076229 
3-benzyl-2-thioxothiazolidin-4-one 
STK060537 
3-benzyl-2-thioxo-thiazolidine-4-one 
AKOS000313296 
CCG-247263 
FCH1317159 
MCULE-5532081304 
NSC-142477 
OR14444 
RP12922 
IDI1_015644 
3-Benzyl-2-thioxo-1,3-thiazolidin-4-one 
KS-000017F2 
BAS 00457025 
SMR001798145 
ZB015718 
AB0156058 
LS-143526 
TR-001185 
BB 0217732 
FT-0681125 
R2028 
4-Thiazolidinone, 3-(phenylmethyl)-2-thioxo- 
ST45022138 
3-Benzyl-2-thioxo-1,3-thiazolidin-4-one # 
C-55592 
I09-2434 
J-511754 
4-Thiazolidinone, 3-(phenylmethyl)-2-thioxo- (9CI) 
C10-H9-N-O-S2 
CID97673 
B1656 
4-27-00-03192 (Beilstein Handbook Reference) 
3-Benzyl-2-thioxo-1,3-thiazolan-4-one 
NSC 142477 
BRN 0155718 
Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: SAR and 3D-QSAR studies on thiadiazolidinone derivatives: exploration of structural requirements for glycogen synthase kinase 3 inhibitors.

Journal: Journal of medicinal chemistry 20051117

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