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1035840-39-1 | 2-piperazin-1-yl-1,3-benzoxazole-5-sulfonamide
CAS No: 1035840-39-1 Catalog No: AG008V62 MDL No:MFCD09701638
Product Description
Catalog Number:
AG008V62
Chemical Name:
2-piperazin-1-yl-1,3-benzoxazole-5-sulfonamide
CAS Number:
1035840-39-1
Molecular Formula:
C11H14N4O3S
Molecular Weight:
282.3189
MDL Number:
MFCD09701638
IUPAC Name:
2-piperazin-1-yl-1,3-benzoxazole-5-sulfonamide
InChI:
InChI=1S/C11H14N4O3S/c12-19(16,17)8-1-2-10-9(7-8)14-11(18-10)15-5-3-13-4-6-15/h1-2,7,13H,3-6H2,(H2,12,16,17)
InChI Key:
JDNQJLVQBNKCAW-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1ccc2c(c1)nc(o2)N1CCNCC1
Properties
Complexity:
418
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
282.318g/mol
Monoisotopic Mass:
282.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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