2-Aminoquinazoline-6-boronic Acid Pinacol Ester - CAS 882670-92-0
Catalog: |
BB038804 |
Product Name: |
2-Aminoquinazoline-6-boronic Acid Pinacol Ester |
CAS: |
882670-92-0 |
Synonyms: |
6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-quinazolinamine; 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinazolin-2-amine |
IUPAC Name: | 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinazolin-2-amine |
Description: | 2-Aminoquinazoline-6-boronic Acid Pinacol Ester (CAS# 882670-92-0 ) is a useful research chemical. |
Molecular Weight: | 271.12 |
Molecular Formula: | C14H18N3O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC3=CN=C(N=C3C=C2)N |
InChI: | InChI=1S/C14H18BN3O2/c1-13(2)14(3,4)20-15(19-13)10-5-6-11-9(7-10)8-17-12(16)18-11/h5-8H,1-4H3,(H2,16,17,18) |
InChI Key: | IDNQSRDVCZCUAJ-UHFFFAOYSA-N |
LogP: | 1.44130 |
Publication Number | Title | Priority Date |
WO-2021165346-A1 | Gcn2 modulator compounds | 20200217 |
EP-3487850-A1 | Urea and thiourea substituted bicycles derivatives as pesticides | 20160722 |
JP-2019523252-A | Urea and thiourea substituted bicyclic derivatives as pest control agents | 20160722 |
US-10687531-B2 | Urea and thiourea substituted bicycles derivatives as pesticides | 20160722 |
US-2019223438-A1 | Urea and thiourea substituted bicycles derivatives as pesticides | 20160722 |
Complexity: | 361 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 271.149207 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 271.149207 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 70.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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