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618-81-5

618-81-5 | 2-Thioxo-4-furfurylideneimidazolidine-5-one

CAS No: 618-81-5 Catalog No: AG00F312 MDL No:

Product Description

Catalog Number:
AG00F312
Chemical Name:
2-Thioxo-4-furfurylideneimidazolidine-5-one
CAS Number:
618-81-5
IUPAC Name:
(5Z)-5-(furan-2-ylmethylidene)-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C8H6N2O2S/c11-7-6(9-8(13)10-7)4-5-2-1-3-12-5/h1-4H,(H2,9,10,11,13)/b6-4-
InChI Key:
GARSQZBFJYWLJC-XQRVVYSFSA-N

Properties

Complexity:
288  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
194.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.208g/mol
Monoisotopic Mass:
194.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Literature

Title Journal
Privileged scaffolds or promiscuous binders: a comparative study on rhodanines and related heterocycles in medicinal chemistry. Journal of medicinal chemistry 20120126
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101

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