Home Other Building Blocks 2,5,6-trimethyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

2,5,6-trimethyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one

CAS No.:
879624-34-7
Catalog Number:
AG01BDZQ
Molecular Formula:
C8H10N4O
Molecular Weight:
178.1912
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Product Description
Catalog Number:
AG01BDZQ
Chemical Name:
2,5,6-trimethyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CAS Number:
879624-34-7
Molecular Formula:
C8H10N4O
Molecular Weight:
178.1912
MDL Number:
MFCD07157457
IUPAC Name:
2,5,6-trimethyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
InChI:
InChI=1S/C8H10N4O/c1-4-5(2)9-8-10-6(3)11-12(8)7(4)13/h1-3H3,(H,9,10,11)
InChI Key:
YNZCUSROEREQGV-UHFFFAOYSA-N
SMILES:
Cc1nc2n(n1)c(=O)c(c([nH]2)C)C
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.085g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.195g/mol
Monoisotopic Mass:
178.085g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties