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183999-59-9 | Imidazo[2,1-b]-1,3,4-thiadiazole-2-sulfonamide,6-(2-oxo-2H-1-benzopyran-3-yl)-
CAS No: 183999-59-9 Catalog No: AG0075VM MDL No:
Product Description
Catalog Number:
AG0075VM
Chemical Name:
Imidazo[2,1-b]-1,3,4-thiadiazole-2-sulfonamide,6-(2-oxo-2H-1-benzopyran-3-yl)-
CAS Number:
183999-59-9
Molecular Formula:
C13H8N4O4S2
Molecular Weight:
348.3570
IUPAC Name:
6-(2-oxochromen-3-yl)imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide
InChI:
InChI=1S/C13H8N4O4S2/c14-23(19,20)13-16-17-6-9(15-12(17)22-13)8-5-7-3-1-2-4-10(7)21-11(8)18/h1-6H,(H2,14,19,20)
InChI Key:
SXWVOIKIEIZZDG-UHFFFAOYSA-N
SMILES:
O=c1oc2ccccc2cc1c1cn2c(n1)sc(n2)S(=O)(=O)N
Properties
Complexity:
647
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.999g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
348.351g/mol
Monoisotopic Mass:
347.999g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
153A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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