Home Other Building Blocks 3-Amino-5-phenylpyrazole

3-Amino-5-phenylpyrazole

CAS No.:
1572-10-7
Catalog Number:
AG001PAI
Molecular Formula:
C9H9N3
Molecular Weight:
159.1879
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$49
- +
10g
98%
In Stock USA
United States
$88
- +
25g
98%
In Stock USA
United States
$175
- +
100g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG001PAI
Chemical Name:
3-Amino-5-phenylpyrazole
CAS Number:
1572-10-7
Molecular Formula:
C9H9N3
Molecular Weight:
159.1879
MDL Number:
MFCD00191749
IUPAC Name:
5-phenyl-1H-pyrazol-3-amine
InChI:
InChI=1S/C9H9N3/c10-9-6-8(11-12-9)7-4-2-1-3-5-7/h1-6H,(H3,10,11,12)
InChI Key:
PWSZRRFDVPMZGM-UHFFFAOYSA-N
SMILES:
Nc1n[nH]c(c1)c1ccccc1
Properties
Complexity:
143  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.08g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
159.192g/mol
Monoisotopic Mass:
159.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Virtual screening identification of nonfolate compounds, including a CNS drug, as antiparasitic agents inhibiting pteridine reductase. Journal of medicinal chemistry 20110113
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
A simple hydrogen-bonded chain in (3Z)-3-{1-[(5-phenyl-1H-pyrazol-3-yl)amino]ethylidene}-4,5-dihydrofuran-2(3H)-one, and a hydrogen-bonded ribbon of centrosymmetric rings in the self-assembled adduct (3Z)-3-{1-[(5-methyl-1H-pyrazol-3-yl)amino]ethylidene}-4,5-dihydrofuran-2(3H)-one-6-(2-hydroxyethyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7(4H)-one (1/1). Acta crystallographica. Section C, Crystal structure communications 20100101
Botulinum neurotoxin serotype A inhibitors: small-molecule mercaptoacetamide analogs. Bioorganic & medicinal chemistry 20090415
Tuning of chemo- and regioselectivities in multicomponent condensations of 5-aminopyrazoles, dimedone, and aldehydes. The Journal of organic chemistry 20080704
Synthesis and biological evaluation of new 3-substituted indole derivatives as potential anti-inflammatory and analgesic agents. Bioorganic & medicinal chemistry 20070601
Properties