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13068-60-5 | Benzenesulfonamide, N-2-benzothiazolyl-
CAS No: 13068-60-5 Catalog No: AG000USZ MDL No:
Product Description
Catalog Number:
AG000USZ
Chemical Name:
Benzenesulfonamide, N-2-benzothiazolyl-
CAS Number:
13068-60-5
Molecular Formula:
C13H10N2O2S2
Molecular Weight:
290.3607
IUPAC Name:
N-(1,3-benzothiazol-2-yl)benzenesulfonamide
InChI:
InChI=1S/C13H10N2O2S2/c16-19(17,10-6-2-1-3-7-10)15-13-14-11-8-4-5-9-12(11)18-13/h1-9H,(H,14,15)
InChI Key:
XOELFPSLJIQWFL-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)Nc1nc2c(s1)cccc2
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.018g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.355g/mol
Monoisotopic Mass:
290.018g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
95.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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