2-(Boc-aminomethyl)-5-bromopyridine - CAS 1188477-11-3
Catalog: |
BB004314 |
Product Name: |
2-(Boc-aminomethyl)-5-bromopyridine |
CAS: |
1188477-11-3 |
Synonyms: |
N-[(5-bromo-2-pyridinyl)methyl]carbamic acid tert-butyl ester; tert-butyl N-[(5-bromopyridin-2-yl)methyl]carbamate |
IUPAC Name: | tert-butyl N-[(5-bromopyridin-2-yl)methyl]carbamate |
Description: | 2-(Boc-aminomethyl)-5-bromopyridine (CAS# 1188477-11-3) is a useful research chemical. |
Molecular Weight: | 287.15 |
Molecular Formula: | C11H15BrN2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC1=NC=C(C=C1)Br |
InChI: | InChI=1S/C11H15BrN2O2/c1-11(2,3)16-10(15)14-7-9-5-4-8(12)6-13-9/h4-6H,7H2,1-3H3,(H,14,15) |
InChI Key: | VZSVACAXEJGOMW-UHFFFAOYSA-N |
MDL: | MFCD11520868 |
LogP: | 3.25970 |
Publication Number | Title | Priority Date |
WO-2021116446-A1 | Functionalized heterocyclic compounds as modulators of stimulator of interferon genes (sting) | 20191211 |
WO-2021116451-A1 | Heterocyclic compounds as modulators of stimulator of interferon genes (sting) | 20191211 |
US-2021317136-A1 | Aminopyridine derivatives as phosphatidylinositol phosphate kinase inhibitors | 20171222 |
WO-2018042342-A1 | 1,2,3-benzotriazole derivatives as ror gamma t modulators | 20160830 |
WO-2017132432-A1 | Benzimidazole derivatives as modulators of ror-gamma | 20160129 |
Complexity: | 241 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 286.03169 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 286.03169 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 51.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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