2-Amino-3,5-dichloropyrazine - CAS 873-42-7
Catalog: |
BB038388 |
Product Name: |
2-Amino-3,5-dichloropyrazine |
CAS: |
873-42-7 |
Synonyms: |
3,5-dichloro-2-pyrazinamine; 3,5-dichloropyrazin-2-amine |
IUPAC Name: | 3,5-dichloropyrazin-2-amine |
Description: | 2-Amino-3,5-dichloropyrazine (CAS# 873-42-7) is used in the synthesis of pyrazinones as inhibitors of protein kinases, which play a key role in the progression of cancer. It is also used in the synthesis of N-substituted pyrazines by tandem reaction ofo-aminohalopyrazines with isothiocyanates. |
Molecular Weight: | 163.99 |
Molecular Formula: | C4H3Cl2N3 |
Canonical SMILES: | C1=C(N=C(C(=N1)N)Cl)Cl |
InChI: | InChI=1S/C4H3Cl2N3/c5-2-1-8-4(7)3(6)9-2/h1H,(H2,7,8) |
InChI Key: | AMRVETKYGCRGPJ-UHFFFAOYSA-N |
Boiling Point: | 275.564 °C at 760 mmHg |
Density: | 1.607 g/cm3 |
MDL: | MFCD11040179 |
LogP: | 1.94680 |
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 |
WO-2021070132-A1 | Bi-aryl dihydroorotate dehydrogenase inhibitors | 20191010 |
WO-2021026099-A1 | Kif18a inhibitors | 20190802 |
WO-2020180768-A1 | Bicyclic heteroaryl compounds and uses thereof | 20190301 |
WO-2019243303-A1 | Pyridinyl and pyrazinyl-(aza)indolsulfonamides | 20180619 |
TW-202016088-A | Pyridyl and pyryl-(nitrogen) indosulfonamide | 20180619 |
Complexity: | 99.8 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.9704025 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.9704025 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 51.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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