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Home > Imidazoles > 89517-95-3
89517-95-3 | 1H-Imidazole-2-sulfonamide, 1-(phenylmethyl)-
CAS No: 89517-95-3 Catalog No: AG0040PF MDL No:
Product Description
Catalog Number:
AG0040PF
Chemical Name:
1H-Imidazole-2-sulfonamide, 1-(phenylmethyl)-
CAS Number:
89517-95-3
Molecular Formula:
C10H11N3O2S
Molecular Weight:
237.2782
IUPAC Name:
1-benzylimidazole-2-sulfonamide
InChI:
InChI=1S/C10H11N3O2S/c11-16(14,15)10-12-6-7-13(10)8-9-4-2-1-3-5-9/h1-7H,8H2,(H2,11,14,15)
InChI Key:
CCIAGLUPGZSEOY-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1nccn1Cc1ccccc1
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.057g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.277g/mol
Monoisotopic Mass:
237.057g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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