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120165-51-7 | Benzenesulfonamide, 4-[[(6-hydroxy-4,5,7-trimethyl-2-benzothiazolyl)amino]methyl]-
CAS No: 120165-51-7 Catalog No: AG000QGI MDL No:
Product Description
Catalog Number:
AG000QGI
Chemical Name:
Benzenesulfonamide, 4-[[(6-hydroxy-4,5,7-trimethyl-2-benzothiazolyl)amino]methyl]-
CAS Number:
120165-51-7
Molecular Formula:
C17H19N3O3S2
Molecular Weight:
377.4811
IUPAC Name:
4-[[(6-hydroxy-4,5,7-trimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide
InChI:
InChI=1S/C17H19N3O3S2/c1-9-10(2)15(21)11(3)16-14(9)20-17(24-16)19-8-12-4-6-13(7-5-12)25(18,22)23/h4-7,21H,8H2,1-3H3,(H,19,20)(H2,18,22,23)
InChI Key:
IKIAJUVGDUYASS-UHFFFAOYSA-N
SMILES:
Cc1c(C)c2nc(sc2c(c1O)C)NCc1ccc(cc1)S(=O)(=O)N
Properties
Complexity:
560
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.087g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
377.477g/mol
Monoisotopic Mass:
377.087g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
142A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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