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Home Other Building Blocks 4-Phenylpyrimidin-2-amine

4-Phenylpyrimidin-2-amine

CAS No.:
2305-87-5
Catalog Number:
AG002M0B
Molecular Formula:
C10H9N3
Molecular Weight:
171.1986
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$35
- +
5g
98%
In Stock USA
United States
$100
- +
25g
98%
In Stock USA
United States
$319
- +
Product Description
Catalog Number:
AG002M0B
Chemical Name:
4-Phenylpyrimidin-2-amine
CAS Number:
2305-87-5
Molecular Formula:
C10H9N3
Molecular Weight:
171.1986
MDL Number:
MFCD00094706
IUPAC Name:
4-phenylpyrimidin-2-amine
InChI:
InChI=1S/C10H9N3/c11-10-12-7-6-9(13-10)8-4-2-1-3-5-8/h1-7H,(H2,11,12,13)
InChI Key:
DMEGQEWPMXDRMO-UHFFFAOYSA-N
SMILES:
Nc1nccc(n1)c1ccccc1
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.08g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
171.203g/mol
Monoisotopic Mass:
171.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Lead generation of heat shock protein 90 inhibitors by a combination of fragment-based approach, virtual screening, and structure-based drug design. Bioorganic & medicinal chemistry letters 20111001
Novel pyrrolo-1,5-benzoxazepine compounds display significant activity against resistant chronic myeloid leukaemia cells in vitro, in ex vivo patient samples and in vivo. British journal of cancer 20100511
Properties