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216308-23-5 | 1H-BENZIMIDAZOLE, 5-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)-2-[5-[4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL]-2-FURANYL]-
CAS No: 216308-23-5 Catalog No: AG007PPG MDL No:
Product Description
Catalog Number:
AG007PPG
Chemical Name:
1H-BENZIMIDAZOLE, 5-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)-2-[5-[4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL]-2-FURANYL]-
CAS Number:
216308-23-5
Molecular Formula:
C23H20N6O
Molecular Weight:
396.4445
IUPAC Name:
6-(4,5-dihydro-1H-imidazol-2-yl)-2-[5-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]furan-2-yl]-1H-benzimidazole
InChI:
InChI=1S/C23H20N6O/c1-3-15(21-24-9-10-25-21)4-2-14(1)19-7-8-20(30-19)23-28-17-6-5-16(13-18(17)29-23)22-26-11-12-27-22/h1-8,13H,9-12H2,(H,24,25)(H,26,27)(H,28,29)
InChI Key:
YZJPVWWVBOFEMQ-UHFFFAOYSA-N
SMILES:
C1CN=C(N1)c1ccc(cc1)c1ccc(o1)c1[nH]c2c(n1)cc(cc2)C1=NCCN1
Properties
Complexity:
687
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.17g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
396.454g/mol
Monoisotopic Mass:
396.17g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Detection of inhibition of bovine viral diarrhea virus by aromatic cationic molecules. | Antimicrobial agents and chemotherapy 20030701 |
| Distribution of furamidine analogues in tumor cells: influence of the number of positive charges. | Journal of medicinal chemistry 20020509 |
| Inhibition of the HIV-1 rev-RRE complex formation by unfused aromatic cations. | Bioorganic & medicinal chemistry 20010501 |
| In vitro antifungal activities of a series of dication-substituted carbazoles, furans, and benzimidazoles. | Antimicrobial agents and chemotherapy 19981001 |
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