5-Amino-3-(methylthio)-4-pyrazolecarboxamide - CAS 90914-35-5
Catalog: |
BB039987 |
Product Name: |
5-Amino-3-(methylthio)-4-pyrazolecarboxamide |
CAS: |
90914-35-5 |
Synonyms: |
5-amino-3-(methylthio)-1H-pyrazole-4-carboxamide; 5-amino-3-methylsulfanyl-1H-pyrazole-4-carboxamide |
IUPAC Name: | 5-amino-3-methylsulfanyl-1H-pyrazole-4-carboxamide |
Description: | 5-Amino-3-(methylthio)-4-pyrazolecarboxamide (CAS# 90914-35-5) is a useful research chemical. |
Molecular Weight: | 172.21 |
Molecular Formula: | C5H8N4OS |
Canonical SMILES: | CSC1=NNC(=C1C(=O)N)N |
InChI: | InChI=1S/C5H8N4OS/c1-11-5-2(4(7)10)3(6)8-9-5/h1H3,(H2,7,10)(H3,6,8,9) |
InChI Key: | MBHLPIXKNRKHEE-UHFFFAOYSA-N |
LogP: | 1.09420 |
Publication Number | Title | Priority Date |
AU-2013295906-A1 | Novel heteroaryl and heterocycle compounds, composition and methods thereof | 20120727 |
AU-2013295906-B2 | Novel heteroaryl and heterocycle compounds, composition and methods thereof | 20120727 |
CA-2880251-A1 | Novel heteroaryl and heterocycle compounds, composition and methods thereof | 20120727 |
CA-2880251-C | Novel heteroaryl and heterocycle compounds, composition and methods thereof | 20120727 |
EP-2877472-A1 | Novel heteroaryl and heterocycle compounds, composition and methods thereof | 20120727 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.04188206 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.04188206 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 123 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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