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19889-43-1 | Guanidine, N-[(3,4-dimethoxyphenyl)methyl]-
CAS No: 19889-43-1 Catalog No: AG002BS1 MDL No:
Product Description
Catalog Number:
AG002BS1
Chemical Name:
Guanidine, N-[(3,4-dimethoxyphenyl)methyl]-
CAS Number:
19889-43-1
Molecular Formula:
C10H15N3O2
Molecular Weight:
209.2450
IUPAC Name:
2-[(3,4-dimethoxyphenyl)methyl]guanidine
InChI:
InChI=1S/C10H15N3O2/c1-14-8-4-3-7(5-9(8)15-2)6-13-10(11)12/h3-5H,6H2,1-2H3,(H4,11,12,13)
InChI Key:
WQPOSQDIXGOFCT-UHFFFAOYSA-N
SMILES:
COc1cc(CNC(=N)N)ccc1OC
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.249g/mol
Monoisotopic Mass:
209.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
82.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Benzylguanidines and other galegine analogues inducing weight loss in mice. | Journal of medicinal chemistry 20090611 |
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