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4745-92-0 | PYRIMIDO[1,6-A]BENZO[D]IMIDAZOLE
CAS No: 4745-92-0 Catalog No: AG0070GG MDL No:
Product Description
Catalog Number:
AG0070GG
Chemical Name:
PYRIMIDO[1,6-A]BENZO[D]IMIDAZOLE
CAS Number:
4745-92-0
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
IUPAC Name:
pyrimido[1,6-a]benzimidazole
InChI:
InChI=1S/C10H7N3/c1-2-4-9-8(3-1)12-10-5-6-11-7-13(9)10/h1-7H
InChI Key:
WSTSOUOPIHOQCP-UHFFFAOYSA-N
SMILES:
c1ncn2c(c1)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 |
|---|---|
| Synthesis, Crystal Structure, and Spectra Properties of the Cadmium (II) Complex with Bis(N-allylbenzimidazol-2-ylmethyl)benzylamine. | Bioinorganic chemistry and applications 20110101 |
| Anti-inflammatory, analgesic and antiamoebic activity evaluation of pyrimido[1,6-a]benzimidazole derivatives synthesized by the reaction of ketoisothiocyanates with mono and diamines. | European journal of medicinal chemistry 20021001 |
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