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142270-80-2 | 1H-Benzimidazole-2-sulfenamide, N-(1,1-dimethylethyl)-
CAS No: 142270-80-2 Catalog No: AG001I43 MDL No:
Product Description
Catalog Number:
AG001I43
Chemical Name:
1H-Benzimidazole-2-sulfenamide, N-(1,1-dimethylethyl)-
CAS Number:
142270-80-2
Molecular Formula:
C11H15N3S
Molecular Weight:
221.3219
IUPAC Name:
N-(1H-benzimidazol-2-ylsulfanyl)-2-methylpropan-2-amine
InChI:
InChI=1S/C11H15N3S/c1-11(2,3)14-15-10-12-8-6-4-5-7-9(8)13-10/h4-7,14H,1-3H3,(H,12,13)
InChI Key:
XWWKPJKHVPXZGD-UHFFFAOYSA-N
SMILES:
CC(NSc1nc2c([nH]1)cccc2)(C)C
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.099g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.322g/mol
Monoisotopic Mass:
221.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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