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144462-46-4 | 1,3,4-Thiadiazole-2-sulfonamide, 5-[[(trifluoromethyl)sulfonyl]amino]-
CAS No: 144462-46-4 Catalog No: AG001JLI MDL No:
Product Description
Catalog Number:
AG001JLI
Chemical Name:
1,3,4-Thiadiazole-2-sulfonamide, 5-[[(trifluoromethyl)sulfonyl]amino]-
CAS Number:
144462-46-4
Molecular Formula:
C3H3F3N4O4S3
Molecular Weight:
312.2705
IUPAC Name:
5-(trifluoromethylsulfonylamino)-1,3,4-thiadiazole-2-sulfonamide
InChI:
InChI=1S/C3H3F3N4O4S3/c4-3(5,6)17(13,14)10-1-8-9-2(15-1)16(7,11)12/h(H,8,10)(H2,7,11,12)
InChI Key:
JHGJJWFACYMJQC-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)Nc1nnc(s1)S(=O)(=O)N)(F)F
NSC Number:
700705
Properties
Complexity:
475
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.927g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
312.256g/mol
Monoisotopic Mass:
311.927g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
177A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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