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Apy29

CAS No.:
1216665-49-4
Catalog Number:
AG0015J5
Molecular Formula:
C17H16N8
Molecular Weight:
332.3625
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥98%
1 week
United States
$172
- +
10mg
≥98%
1 week
United States
$264
- +
25mg
≥98%
1 week
United States
$518
- +
50mg
≥98%
1 week
United States
$748
- +
Product Description
Catalog Number:
AG0015J5
Chemical Name:
Apy29
CAS Number:
1216665-49-4
Molecular Formula:
C17H16N8
Molecular Weight:
332.3625
MDL Number:
MFCD28023582
IUPAC Name:
2-N-(3H-benzimidazol-5-yl)-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine
InChI:
InChI=1S/C17H16N8/c1-2-10(1)13-8-16(25-24-13)22-15-5-6-18-17(23-15)21-11-3-4-12-14(7-11)20-9-19-12/h3-10H,1-2H2,(H,19,20)(H3,18,21,22,23,24,25)
InChI Key:
WJNBSTLIALIIEW-UHFFFAOYSA-N
SMILES:
c1cc(nc(n1)Nc1ccc2c(c1)[nH]cn2)Nc1n[nH]c(c1)C1CC1
Properties
Complexity:
458  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.15g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
332.371g/mol
Monoisotopic Mass:
332.15g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties