Home Halogens 8-bromopyrazolo[1,5-a][1,3,5]triazine-2,4-diamine

8-bromopyrazolo[1,5-a][1,3,5]triazine-2,4-diamine

CAS No.:
1783318-15-9
Catalog Number:
AG01DYXD
Molecular Formula:
C5H5BrN6
Molecular Weight:
229.0374
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Product Description
Catalog Number:
AG01DYXD
Chemical Name:
8-bromopyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
CAS Number:
1783318-15-9
Molecular Formula:
C5H5BrN6
Molecular Weight:
229.0374
MDL Number:
MFCD28643017
IUPAC Name:
8-bromopyrazolo[1,5-a][1,3,5]triazine-2,4-diamine
InChI:
InChI=1S/C5H5BrN6/c6-2-1-9-12-3(2)10-4(7)11-5(12)8/h1H,(H4,7,8,10,11)
InChI Key:
YPWPLWLTSDXLOM-UHFFFAOYSA-N
SMILES:
Nc1nc(N)n2c(n1)c(Br)cn2
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.976g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.041g/mol
Monoisotopic Mass:
227.976g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties