4-Bromo-2-(methylamino)pyridine - CAS 468718-65-2
Catalog: |
BB026188 |
Product Name: |
4-Bromo-2-(methylamino)pyridine |
CAS: |
468718-65-2 |
Synonyms: |
4-bromo-N-methyl-2-pyridinamine; 4-bromo-N-methylpyridin-2-amine |
IUPAC Name: | 4-bromo-N-methylpyridin-2-amine |
Description: | 4-Bromo-2-(methylamino)pyridine (CAS# 468718-65-2) is an intermediate in the synthesis of B-[2-(Methylamino)-4-pyridinyl]boronic Acid Hydrochlroide Hydrate (M227308), which is used to prepare novel selective thiazoleacetic acids as CRTH2 antagonists. |
Molecular Weight: | 187.04 |
Molecular Formula: | C6H7BrN2 |
Canonical SMILES: | CNC1=NC=CC(=C1)Br |
InChI: | InChI=1S/C6H7BrN2/c1-8-6-4-5(7)2-3-9-6/h2-4H,1H3,(H,8,9) |
InChI Key: | ZWIJDMCKZGENFF-UHFFFAOYSA-N |
MDL: | MFCD09834845 |
LogP: | 1.30770 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112574211-A | Heterocyclic kinase inhibitors | 20190929 |
WO-2020189540-A1 | Method for preparing aromatic amino acid derivative | 20190315 |
WO-2020160180-A1 | Compounds and uses thereof | 20190129 |
WO-2020113233-A1 | Irak degraders and uses thereof | 20181130 |
CN-113423427-A | IRAK degrading agents and uses thereof | 20181130 |
Complexity: | 87.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.97926 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.97926 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 24.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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