1-Methylimidazole-4-carboxamide - CAS 129993-47-1
Catalog: |
BB007035 |
Product Name: |
1-Methylimidazole-4-carboxamide |
CAS: |
129993-47-1 |
Synonyms: |
1-methyl-4-imidazolecarboxamide; 1-methylimidazole-4-carboxamide |
IUPAC Name: | 1-methylimidazole-4-carboxamide |
Description: | 1-Methylimidazole-4-carboxamide (CAS# 129993-47-1) is a useful research chemical. |
Molecular Weight: | 125.13 |
Molecular Formula: | C5H7N3O |
Canonical SMILES: | CN1C=C(N=C1)C(=O)N |
InChI: | InChI=1S/C5H7N3O/c1-8-2-4(5(6)9)7-3-8/h2-3H,1H3,(H2,6,9) |
InChI Key: | AWDCMXSTPBEJMX-UHFFFAOYSA-N |
Boiling Point: | 444.8 °C at 760 mmHg |
Density: | 1.34 g/cm3 |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD11054183 |
LogP: | 0.21930 |
Publication Number | Title | Priority Date |
WO-2018235813-A1 | IMIDAZOLE DERIVATIVE AND MEDICINE COMPRISING THE SAME | 20170621 |
TW-201838981-A | Pyrimidinyl-pyridyloxy-naphthyl compound and method for treating IRE1 related diseases and disorders | 20170317 |
EP-3568390-A1 | Small molecule activators of nicotinamide phosphoribosyltransferase (nampt) and uses thereof | 20170110 |
WO-2018132372-A1 | Small molecule activators of nicotinamide phosphoribosyltransferase (nampt) and uses thereof | 20170110 |
US-2021161873-A1 | Small molecule activators of nicotinamide phosphoribosyltransferase (nampt) and uses thereof | 20170110 |
Complexity: | 125 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 125.058911855 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 125.058911855 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 60.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.8 |
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