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13114-64-2 | Urea, N-2-pyridinyl-
CAS No: 13114-64-2 Catalog No: AG000VMD MDL No:MFCD04973337
Product Description
Catalog Number:
AG000VMD
Chemical Name:
Urea, N-2-pyridinyl-
CAS Number:
13114-64-2
Molecular Formula:
C6H7N3O
Molecular Weight:
137.1393
MDL Number:
MFCD04973337
IUPAC Name:
pyridin-2-ylurea
InChI:
InChI=1S/C6H7N3O/c7-6(10)9-5-3-1-2-4-8-5/h1-4H,(H3,7,8,9,10)
InChI Key:
MQDVUDAZJMZQMF-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1ccccn1
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
137.142g/mol
Monoisotopic Mass:
137.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
| Title | Journal |
|---|---|
| Dichlorido[1-(2-chloro-eth-yl)-3-(pyridin-4-ylmethyl-κN)urea](η-hexa-methyl-benzene)-ruthenium(II) chloro-form monosolvate. | Acta crystallographica. Section E, Structure reports online 20111101 |
| Synthesis and biological evaluation of glycogen synthase kinase 3 (GSK-3) inhibitors: an fast and atom efficient access to 1-aryl-3-benzylureas. | Bioorganic & medicinal chemistry letters 20110915 |
| Sulfate encapsulation in a metal-assisted capsule based on a mono-pyridylurea ligand. | Chemical communications (Cambridge, England) 20110314 |
| Alkali metal ions as probes of structure and recognition properties of macrocyclic pyridyl urea hosts. | The Journal of organic chemistry 20100820 |
| Ion-pair binding by mixed N,S-donor 2-ureidopyridine ligands. | Dalton transactions (Cambridge, England : 2003) 20090807 |
| Attractive strain: the disadvantages of rigid multiple H-bond donors and acceptors. A theoretical analysis of the hydrogen-bonding interactions in complexes of tetraazaanthracenedione with pyridylureas. | The journal of physical chemistry. B 20080214 |
| The first urea azine molecule and its coordination to uranium in the first actinide guanidinate complexes. | Chemical communications (Cambridge, England) 20070719 |
| First snapshot of a nonpolymeric hydrogelator interacting with its gelling solvents. | Chemical communications (Cambridge, England) 20050828 |
| Silver(I) coordination polymers containing heteroditopic ureidopyridine ligands: the role of ligand isomerism, hydrogen bonding, and stacking interactions. | Inorganic chemistry 20050808 |
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