2-(Aminomethyl)-5-cyanothiophene - CAS 227279-10-9
Catalog: |
BB017725 |
Product Name: |
2-(Aminomethyl)-5-cyanothiophene |
CAS: |
227279-10-9 |
Synonyms: |
5-(aminomethyl)-2-thiophenecarbonitrile; 5-(aminomethyl)thiophene-2-carbonitrile |
IUPAC Name: | 5-(aminomethyl)thiophene-2-carbonitrile |
Description: | 2-(Aminomethyl)-5-cyanothiophene (CAS# 227279-10-9) is a useful research chemical compound. |
Molecular Weight: | 138.19 |
Molecular Formula: | C6H6N2S |
Canonical SMILES: | C1=C(SC(=C1)C#N)CN |
InChI: | InChI=1S/C6H6N2S/c7-3-5-1-2-6(4-8)9-5/h1-2H,3,7H2 |
InChI Key: | FHYNZXSHHPBOBK-UHFFFAOYSA-N |
LogP: | 1.77878 |
Publication Number | Title | Priority Date |
US-2021171512-A1 | Masp-2 inhibitors and methods of use | 20191204 |
US-2021171531-A1 | Masp-2 inhibitors and methods of use | 20191204 |
WO-2021113682-A1 | Masp-2 inhibitors and methods of use | 20191204 |
WO-2021113690-A1 | Masp-2 inhibitors and methods of use | 20191204 |
EP-2731942-A1 | Novel 2-piperidin-1-yl-acetamide compounds for use as tankyrase inhibitors | 20110713 |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 138.02516937 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 138.02516937 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 78 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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