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89208-08-2

89208-08-2 | Isothiazolo[5,4-b]pyridine-2(3H)-carboxamide, N-(1-methylethyl)-3-oxo-

CAS No: 89208-08-2 Catalog No: AG00445R MDL No:

Product Description

Catalog Number:
AG00445R
Chemical Name:
Isothiazolo[5,4-b]pyridine-2(3H)-carboxamide, N-(1-methylethyl)-3-oxo-
CAS Number:
89208-08-2
Molecular Formula:
C10H11N3O2S
Molecular Weight:
237.2782
IUPAC Name:
3-oxo-N-propan-2-yl-[1,2]thiazolo[5,4-b]pyridine-2-carboxamide
InChI:
InChI=1S/C10H11N3O2S/c1-6(2)12-10(15)13-9(14)7-4-3-5-11-8(7)16-13/h3-6H,1-2H3,(H,12,15)
InChI Key:
OBJBUZLPAPIEBV-UHFFFAOYSA-N
SMILES:
CC(NC(=O)n1sc2c(c1=O)cccn2)C

Properties

Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.277g/mol
Monoisotopic Mass:
237.057g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
87.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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