3-Amino-5-(tert-butyl)-1,2,4-oxadiazole - CAS 91362-43-5
Catalog: |
BB040135 |
Product Name: |
3-Amino-5-(tert-butyl)-1,2,4-oxadiazole |
CAS: |
91362-43-5 |
Synonyms: |
5-tert-butyl-1,2,4-oxadiazol-3-amine; 5-tert-butyl-1,2,4-oxadiazol-3-amine |
IUPAC Name: | 5-tert-butyl-1,2,4-oxadiazol-3-amine |
Description: | 3-Amino-5-(tert-butyl)-1,2,4-oxadiazole (CAS# 91362-43-5) is a useful research chemical. |
Molecular Weight: | 141.17 |
Molecular Formula: | C6H11N3O |
Canonical SMILES: | CC(C)(C)C1=NC(=NO1)N |
InChI: | InChI=1S/C6H11N3O/c1-6(2,3)4-8-5(7)9-10-4/h1-3H3,(H2,7,9) |
InChI Key: | VAYGOKAONCMZCM-UHFFFAOYSA-N |
LogP: | 0.87940 |
Publication Number | Title | Priority Date |
TW-201841909-A | Bruton's tyrosine kinase inhibitor | 20170414 |
US-2017088561-A1 | Boronic acid derivatives and therapeutic uses thereof | 20140519 |
US-9963467-B2 | Boronic acid derivatives and therapeutic uses thereof | 20140519 |
KR-20150135458-A | Novel pyridine derivatives | 20130326 |
EP-3072886-B1 | Pyridin-2-amides useful as cb2 agonists | 20110610 |
Complexity: | 121 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 141.090211983 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 141.090211983 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 64.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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