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849199-60-6 | Imidazo[1,5-a]pyrazin-8(7H)-one, 5-(4-methoxyphenyl)-
CAS No: 849199-60-6 Catalog No: AG008FRP MDL No:
Product Description
Catalog Number:
AG008FRP
Chemical Name:
Imidazo[1,5-a]pyrazin-8(7H)-one, 5-(4-methoxyphenyl)-
CAS Number:
849199-60-6
Molecular Formula:
C13H11N3O2
Molecular Weight:
241.2453
IUPAC Name:
5-(4-methoxyphenyl)-7H-imidazo[1,5-a]pyrazin-8-one
InChI:
InChI=1S/C13H11N3O2/c1-18-10-4-2-9(3-5-10)11-7-15-13(17)12-6-14-8-16(11)12/h2-8H,1H3,(H,15,17)
InChI Key:
DDVNWMVOZLTUGW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1c[nH]c(=O)c2n1cnc2
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.25g/mol
Monoisotopic Mass:
241.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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