4-Aminotetrahydrothiopyran-4-carbonitrile - CAS 50289-20-8
Catalog: |
BB026993 |
Product Name: |
4-Aminotetrahydrothiopyran-4-carbonitrile |
CAS: |
50289-20-8 |
Synonyms: |
4-amino-4-thianecarbonitrile; 4-aminothiane-4-carbonitrile |
IUPAC Name: | 4-aminothiane-4-carbonitrile |
Description: | 4-Aminotetrahydrothiopyran-4-carbonitrile (CAS# 50289-20-8) is a useful research chemical. |
Molecular Weight: | 142.22 |
Molecular Formula: | C6H10N2S |
Canonical SMILES: | C1CSCCC1(C#N)N |
InChI: | InChI=1S/C6H10N2S/c7-5-6(8)1-3-9-4-2-6/h1-4,8H2 |
InChI Key: | CYWPCNCIUAEHBD-UHFFFAOYSA-N |
Boiling Point: | 297.741 °C at 760 mmHg |
Density: | 1.172 g/cm3 |
LogP: | 1.43478 |
Publication Number | Title | Priority Date |
EP-2763976-A1 | 2-pyridyl carboxamide-containing spleen tyrosine kinase (syk) inhibitors | 20111005 |
EP-2763976-B1 | 2-pyridyl carboxamide-containing spleen tyrosine kinase (syk) inhibitors | 20111005 |
US-2014243336-A1 | 2-Pyridyl Carboxamide-Containing Spleen Tyrosine Kinase (SYK) Inhibitors | 20111005 |
US-9216173-B2 | 2-Pyridyl carboxamide-containing spleen tyrosine kinase (SYK) inhibitors | 20111005 |
WO-2013052394-A1 | 2-pyridyl carboxamide-containing spleen tyrosine kinase (syk) inhibitors | 20111005 |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.0564695 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.0564695 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 75.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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