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Home Nitriles 5-(1-tert-butyl-1H-pyrazol-4-yl)-7-oxo-6-(propan-2-yl)-1H,7H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

5-(1-tert-butyl-1H-pyrazol-4-yl)-7-oxo-6-(propan-2-yl)-1H,7H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

CAS No.:
1628210-26-3
Catalog Number:
AG01BHV8
Molecular Formula:
C17H20N6O
Molecular Weight:
324.3803
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
99%
1 week
United States
$240
- +
5mg
99%
1 week
United States
$607
- +
10mg
99%
1 week
United States
$890
- +
50mg
99%
1 week
United States
$2557
- +
100mg
99%
1 week
United States
$3557
- +
Product Description
Catalog Number:
AG01BHV8
Chemical Name:
5-(1-tert-butyl-1H-pyrazol-4-yl)-7-oxo-6-(propan-2-yl)-1H,7H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CAS Number:
1628210-26-3
Molecular Formula:
C17H20N6O
Molecular Weight:
324.3803
MDL Number:
MFCD30747843
IUPAC Name:
5-(1-tert-butylpyrazol-4-yl)-7-oxo-6-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
InChI:
InChI=1S/C17H20N6O/c1-10(2)13-14(12-8-19-22(9-12)17(3,4)5)21-15-11(6-18)7-20-23(15)16(13)24/h7-10,20H,1-5H3
InChI Key:
YQCOPPONWZNBQO-UHFFFAOYSA-N
SMILES:
N#Cc1c[nH]n2c1nc(c1cnn(c1)C(C)(C)C)c(c2=O)C(C)C
Properties
Complexity:
715  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.17g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
324.388g/mol
Monoisotopic Mass:
324.17g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties