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101752-15-2 | Imidazo[1,5-a]pyrimidine-8-carboxamide, 1,2,3,4-tetrahydro-2-oxo-
CAS No: 101752-15-2 Catalog No: AG0005EM MDL No:
Product Description
Catalog Number:
AG0005EM
Chemical Name:
Imidazo[1,5-a]pyrimidine-8-carboxamide, 1,2,3,4-tetrahydro-2-oxo-
CAS Number:
101752-15-2
Molecular Formula:
C7H8N4O2
Molecular Weight:
180.1640
IUPAC Name:
2-oxo-3,4-dihydro-1H-imidazo[1,5-a]pyrimidine-8-carboxamide
InChI:
InChI=1S/C7H8N4O2/c8-6(13)5-7-10-4(12)1-2-11(7)3-9-5/h3H,1-2H2,(H2,8,13)(H,10,12)
InChI Key:
NIFCQJMXJDJZPB-UHFFFAOYSA-N
SMILES:
O=C1CCn2c(N1)c(nc2)C(=O)N
NSC Number:
624641
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.065g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.167g/mol
Monoisotopic Mass:
180.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
90A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6
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