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138474-57-4 | Benzenamine, N-2-imidazolidinylidene-
CAS No: 138474-57-4 Catalog No: AG00198I MDL No:
Product Description
Catalog Number:
AG00198I
Chemical Name:
Benzenamine, N-2-imidazolidinylidene-
CAS Number:
138474-57-4
Molecular Formula:
C9H11N3
Molecular Weight:
161.2037
IUPAC Name:
N-phenyl-4,5-dihydro-1H-imidazol-2-amine
InChI:
InChI=1S/C9H11N3/c1-2-4-8(5-3-1)12-9-10-6-7-11-9/h1-5H,6-7H2,(H2,10,11,12)
InChI Key:
JCOPITWIWLFFPC-UHFFFAOYSA-N
SMILES:
C1CNC(=Nc2ccccc2)N1
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
161.208g/mol
Monoisotopic Mass:
161.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| New bis(2-aminoimidazoline) and bisguanidine DNA minor groove binders with potent in vivo antitrypanosomal and antiplasmodial activity. | Journal of medicinal chemistry 20080227 |
| 2-(Anilino)imidazolines and 2-(benzyl)imidazoline derivatives as h5-HT1D serotonin receptor ligands. | Bioorganic & medicinal chemistry letters 20040920 |
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