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787590-70-9 | Urea, N-butyl-N'-(3-phenylimidazo[1,2-a]pyrazin-8-yl)-
CAS No: 787590-70-9 Catalog No: AG008LV6 MDL No:
Product Description
Catalog Number:
AG008LV6
Chemical Name:
Urea, N-butyl-N'-(3-phenylimidazo[1,2-a]pyrazin-8-yl)-
CAS Number:
787590-70-9
Molecular Formula:
C17H19N5O
Molecular Weight:
309.3657
IUPAC Name:
1-butyl-3-(3-phenylimidazo[1,2-a]pyrazin-8-yl)urea
InChI:
InChI=1S/C17H19N5O/c1-2-3-9-19-17(23)21-15-16-20-12-14(22(16)11-10-18-15)13-7-5-4-6-8-13/h4-8,10-12H,2-3,9H2,1H3,(H2,18,19,21,23)
InChI Key:
QGYGATLHYVZXEG-UHFFFAOYSA-N
SMILES:
CCCCNC(=O)Nc1nccn2c1ncc2c1ccccc1
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.159g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
309.373g/mol
Monoisotopic Mass:
309.159g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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