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177843-18-4 | 1H-Benzimidazol-6-amine, N-(4,5-dihydro-1H-imidazol-2-yl)-
CAS No: 177843-18-4 Catalog No: AG0025KT MDL No:
Product Description
Catalog Number:
AG0025KT
Chemical Name:
1H-Benzimidazol-6-amine, N-(4,5-dihydro-1H-imidazol-2-yl)-
CAS Number:
177843-18-4
Molecular Formula:
C10H11N5
Molecular Weight:
201.2278
IUPAC Name:
N-(4,5-dihydro-1H-imidazol-2-yl)-3H-benzimidazol-5-amine
InChI:
InChI=1S/C10H11N5/c1-2-8-9(14-6-13-8)5-7(1)15-10-11-3-4-12-10/h1-2,5-6H,3-4H2,(H,13,14)(H2,11,12,15)
InChI Key:
DPXMAQCBFXYNLT-UHFFFAOYSA-N
SMILES:
C1CN=C(N1)Nc1ccc2c(c1)[nH]cn2
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
201.233g/mol
Monoisotopic Mass:
201.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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