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141234-25-5 | Imidazo[1,2-a]pyrimidine-6-carboxamide, N-butyl-1,2,3,5-tetrahydro-5-oxo-1-phenyl-
CAS No: 141234-25-5 Catalog No: AG001G4E MDL No:
Product Description
Catalog Number:
AG001G4E
Chemical Name:
Imidazo[1,2-a]pyrimidine-6-carboxamide, N-butyl-1,2,3,5-tetrahydro-5-oxo-1-phenyl-
CAS Number:
141234-25-5
Molecular Formula:
C17H20N4O2
Molecular Weight:
312.3663
IUPAC Name:
N-butyl-5-oxo-1-phenyl-2,3-dihydroimidazo[1,2-a]pyrimidine-6-carboxamide
InChI:
InChI=1S/C17H20N4O2/c1-2-3-9-18-15(22)14-12-19-17-20(10-11-21(17)16(14)23)13-7-5-4-6-8-13/h4-8,12H,2-3,9-11H2,1H3,(H,18,22)
InChI Key:
CDICWFQTSBUXPO-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)c1cnc2n(c1=O)CCN2c1ccccc1
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.159g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.373g/mol
Monoisotopic Mass:
312.159g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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