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Home > Imidazoles > 53976-95-7
53976-95-7 | N-(4-methoxyphenyl)imidazolidin-2-imine
CAS No: 53976-95-7 Catalog No: AG01AFAG MDL No:MFCD20542255
Product Description
Catalog Number:
AG01AFAG
Chemical Name:
N-(4-methoxyphenyl)imidazolidin-2-imine
CAS Number:
53976-95-7
Molecular Formula:
C10H13N3O
Molecular Weight:
191.2297
MDL Number:
MFCD20542255
IUPAC Name:
N-(4-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine
InChI:
InChI=1S/C10H13N3O/c1-14-9-4-2-8(3-5-9)13-10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H2,11,12,13)
InChI Key:
ZCGHVGWHOPGTES-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)N=C1NCCN1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.234g/mol
Monoisotopic Mass:
191.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Guanidine and 2-aminoimidazoline aromatic derivatives as alpha2-adrenoceptor antagonists. 2. Exploring alkyl linkers for new antidepressants. | Journal of medicinal chemistry 20080612 |
| Guanidine and 2-aminoimidazoline aromatic derivatives as alpha(2)-adrenoceptor antagonists, 1: toward new antidepressants with heteroatomic linkers. | Journal of medicinal chemistry 20070906 |
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