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245-55-6 | Pyrimido[1,2-a]benzimidazole
CAS No: 245-55-6 Catalog No: AG002OC3 MDL No:
Product Description
Catalog Number:
AG002OC3
Chemical Name:
Pyrimido[1,2-a]benzimidazole
CAS Number:
245-55-6
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
IUPAC Name:
pyrimido[1,2-a]benzimidazole
InChI:
InChI=1S/C10H7N3/c1-2-5-9-8(4-1)12-10-11-6-3-7-13(9)10/h1-7H
InChI Key:
HOHWYQSDLRTVDK-UHFFFAOYSA-N
SMILES:
c1ccn2c(n1)nc1c2cccc1
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.064g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.187g/mol
Monoisotopic Mass:
169.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Design, synthesis and bioevaluation of dihydropyrazolo[3,4-b]pyridine and benzo[4,5]imidazo[1,2-a]pyrimidine compounds as dual KSP and Aurora-A kinase inhibitors for anti-cancer agents. | Bioorganic & medicinal chemistry 20101115 |
| Ethyl 4-(4-nitro-phen-yl)-2-(trifluoro-meth-yl)pyrimido[1,2-a]benzimidazole-3-carboxyl-ate. | Acta crystallographica. Section E, Structure reports online 20081201 |
| Synthesis and analgesic/anti-inflammatory evaluation of fused heterocyclic ring systems incorporating phenylsulfonyl moiety. | Bioorganic & medicinal chemistry 20080615 |
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