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1072069-55-6 | 2-Cyano-N-(5-sulfamoyl-1,3-benzothiazol-2-yl)acetamide
CAS No: 1072069-55-6 Catalog No: AG01F7VW MDL No:
Product Description
Catalog Number:
AG01F7VW
Chemical Name:
2-Cyano-N-(5-sulfamoyl-1,3-benzothiazol-2-yl)acetamide
CAS Number:
1072069-55-6
Molecular Formula:
C10H8N4O3S2
Molecular Weight:
296.3255
IUPAC Name:
2-cyano-N-(5-sulfamoyl-1,3-benzothiazol-2-yl)acetamide
InChI:
InChI=1S/C10H8N4O3S2/c11-4-3-9(15)14-10-13-7-5-6(19(12,16)17)1-2-8(7)18-10/h1-2,5H,3H2,(H2,12,16,17)(H,13,14,15)
InChI Key:
RFHQFEFZAWXCQU-UHFFFAOYSA-N
SMILES:
N#CCC(=O)Nc1nc2c(s1)ccc(c2)S(=O)(=O)N
Properties
Complexity:
507
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.004g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
296.319g/mol
Monoisotopic Mass:
296.004g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
163A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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