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83-39-6 | Imidazole-4,5-dicarboxamide , 97%
CAS No: 83-39-6 Catalog No: AG003QZN MDL No:MFCD00047022
Product Description
Catalog Number:
AG003QZN
Chemical Name:
Imidazole-4,5-dicarboxamide , 97%
CAS Number:
83-39-6
Molecular Formula:
C5H6N4O2
Molecular Weight:
154.1267
MDL Number:
MFCD00047022
IUPAC Name:
1H-imidazole-4,5-dicarboxamide
InChI:
InChI=1S/C5H6N4O2/c6-4(10)2-3(5(7)11)9-1-8-2/h1H,(H2,6,10)(H2,7,11)(H,8,9)
InChI Key:
NNWAARLSYSBVPB-UHFFFAOYSA-N
SMILES:
NC(=O)c1[nH]cnc1C(=O)N
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.049g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
154.129g/mol
Monoisotopic Mass:
154.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.1
Literature
| Title | Journal |
|---|---|
| Parallel synthesis of an oligomeric imidazole-4,5-dicarboxamide library. | Journal of combinatorial chemistry 20100308 |
| Structural studies of pterin-based inhibitors of dihydropteroate synthase. | Journal of medicinal chemistry 20100114 |
| Identification of aquaporin 4 inhibitors using in vitro and in silico methods. | Bioorganic & medicinal chemistry 20090101 |
| Parallel synthesis of an imidazole-4,5-dicarboxamide library bearing amino acid esters and alkanamines. | Molecules (Basel, Switzerland) 20081215 |
| Imidazole-4,5-dicarboxamide derivatives with antiproliferative activity against HL-60 cells. | Journal of medicinal chemistry 20050922 |
| In vitro cultivation of Cryptosporidium parvum and screening for anticryptosporidial drugs. | Antimicrobial agents and chemotherapy 19900801 |
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