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857540-99-9 | 4-[(1,3-thiazol-2-yl)sulfamoyl]benzoic acid
CAS No: 857540-99-9 Catalog No: AG01A0E0 MDL No:MFCD07393338
Product Description
Catalog Number:
AG01A0E0
Chemical Name:
4-[(1,3-thiazol-2-yl)sulfamoyl]benzoic acid
CAS Number:
857540-99-9
Molecular Formula:
C10H8N2O4S2
Molecular Weight:
284.3115
MDL Number:
MFCD07393338
IUPAC Name:
4-(1,3-thiazol-2-ylsulfamoyl)benzoic acid
InChI:
InChI=1S/C10H8N2O4S2/c13-9(14)7-1-3-8(4-2-7)18(15,16)12-10-11-5-6-17-10/h1-6H,(H,11,12)(H,13,14)
InChI Key:
NIMGAAOSOLCXAO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)S(=O)(=O)Nc1nccs1
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.993g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
284.304g/mol
Monoisotopic Mass:
283.993g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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