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Home Aminos 2H-Indol-2-one, 5-(2-amino-4-thiazolyl)-1,3-dihydro-

2H-Indol-2-one, 5-(2-amino-4-thiazolyl)-1,3-dihydro-

CAS No.:
105316-99-2
Catalog Number:
AG00HAMV
Molecular Formula:
C11H9N3OS
Molecular Weight:
231.2737
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Product Description
Catalog Number:
AG00HAMV
Chemical Name:
2H-Indol-2-one, 5-(2-amino-4-thiazolyl)-1,3-dihydro-
CAS Number:
105316-99-2
Molecular Formula:
C11H9N3OS
Molecular Weight:
231.2737
MDL Number:
MFCD06385034
IUPAC Name:
5-(2-amino-1,3-thiazol-4-yl)-1,3-dihydroindol-2-one
InChI:
InChI=1S/C11H9N3OS/c12-11-14-9(5-16-11)6-1-2-8-7(3-6)4-10(15)13-8/h1-3,5H,4H2,(H2,12,14)(H,13,15)
InChI Key:
YRPIIMJICPLJAO-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)cc(cc2)c1csc(n1)N
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.047g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.273g/mol
Monoisotopic Mass:
231.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
96.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties