4-Amino-2-pyridone - CAS 38767-72-5
Catalog: |
BB023753 |
Product Name: |
4-Amino-2-pyridone |
CAS: |
38767-72-5 |
Synonyms: |
4-amino-1H-pyridin-2-one; 4-amino-1H-pyridin-2-one |
IUPAC Name: | 4-amino-1H-pyridin-2-one |
Description: | 4-Amino-2-pyridone (CAS# 38767-72-5) is used in the preparation of nucleoside analogues with antitumor and antiviral activity. |
Molecular Weight: | 110.11 |
Molecular Formula: | C5H6N2O |
Canonical SMILES: | C1=CNC(=O)C=C1N |
InChI: | InChI=1S/C5H6N2O/c6-4-1-2-7-5(8)3-4/h1-3H,(H3,6,7,8) |
InChI Key: | SBQVQYPJWLJRQT-UHFFFAOYSA-N |
Boiling Point: | 310.7 °C at 760 mmHg |
Density: | 1.208 g/cm3 |
MDL: | MFCD02682913 |
LogP: | 0.95060 |
GHS Hazard Statement: | H301 (33.33%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021003314-A1 | Heterocyclic compounds as kinase inhibitors | 20190702 |
WO-2020224568-A1 | Cdk inhibitors | 20190505 |
US-2019248774-A1 | Heterocyclic compounds as kinase inhibitors | 20180215 |
WO-2019161224-A1 | Heterocyclic compounds as kinase inhibitors | 20180215 |
AU-2019220746-A1 | Heterocyclic compounds as kinase inhibitors | 20180215 |
PMID | Publication Date | Title | Journal |
19936759 | 20100301 | Role of Rho-kinase in mediating contraction of chicken embryo femoral arteries | Journal of comparative physiology. B, Biochemical, systemic, and environmental physiology |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 110.048012819 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 110.048012819 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.8 |
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Amines and Anilines
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