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208335-92-6 | 1H-Benzimidazol-2-amine, 6-iodo-1-[(1-methylethyl)sulfonyl]-
CAS No: 208335-92-6 Catalog No: AG002JN6 MDL No:
Product Description
Catalog Number:
AG002JN6
Chemical Name:
1H-Benzimidazol-2-amine, 6-iodo-1-[(1-methylethyl)sulfonyl]-
CAS Number:
208335-92-6
Molecular Formula:
C10H12IN3O2S
Molecular Weight:
365.1906
IUPAC Name:
6-iodo-1-propan-2-ylsulfonylbenzimidazol-2-amine
InChI:
InChI=1S/C10H12IN3O2S/c1-6(2)17(15,16)14-9-5-7(11)3-4-8(9)13-10(14)12/h3-6H,1-2H3,(H2,12,13)
InChI Key:
YNVRCMSDPRDQKQ-UHFFFAOYSA-N
SMILES:
CC(S(=O)(=O)n1c(N)nc2c1cc(I)cc2)C
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.969g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
365.189g/mol
Monoisotopic Mass:
364.969g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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