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88373-93-7 | [1,2,4]Triazolo[1,5-a]pyrimidine-5-acetamide, 7-hydroxy-N-propyl-
CAS No: 88373-93-7 Catalog No: AG004ISX MDL No:
Product Description
Catalog Number:
AG004ISX
Chemical Name:
[1,2,4]Triazolo[1,5-a]pyrimidine-5-acetamide, 7-hydroxy-N-propyl-
CAS Number:
88373-93-7
Molecular Formula:
C10H13N5O2
Molecular Weight:
235.2425
IUPAC Name:
2-(7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-yl)-N-propylacetamide
InChI:
InChI=1S/C10H13N5O2/c1-2-3-11-8(16)4-7-5-9(17)15-10(14-7)12-6-13-15/h5-6H,2-4H2,1H3,(H,11,16)(H,12,13,14)
InChI Key:
NWGUXHHYZJLBHS-UHFFFAOYSA-N
SMILES:
CCCNC(=O)Cc1cc(O)n2c(n1)ncn2
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.107g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
235.247g/mol
Monoisotopic Mass:
235.107g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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