7-Boc-3-bromo-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine - CAS 949922-61-6
Catalog: |
BB041596 |
Product Name: |
7-Boc-3-bromo-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine |
CAS: |
949922-61-6 |
Synonyms: |
3-bromo-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylic acid tert-butyl ester; tert-butyl 3-bromo-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate |
IUPAC Name: | tert-butyl 3-bromo-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate |
Description: | 7-Boc-3-bromo-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine (CAS# 949922-61-6 ) is a useful research chemical. |
Molecular Weight: | 302.17 |
Molecular Formula: | C11H16BrN3O2 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCN2C(=NC=C2Br)C1 |
InChI: | InChI=1S/C11H16BrN3O2/c1-11(2,3)17-10(16)14-4-5-15-8(12)6-13-9(15)7-14/h6H,4-5,7H2,1-3H3 |
InChI Key: | YTGNTPFZMKDHEY-UHFFFAOYSA-N |
Boiling Point: | 432.371 °C at 760 mmHg |
Density: | 1.525 g/cm3 |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 2.33420 |
GHS Hazard Statement: | H302 (50%): 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-2021121371-A1 | Kras g12c inhibitor and pharmaceutical use thereof | 20191219 |
WO-2021065980-A1 | Bet degrader | 20190930 |
US-2021078996-A1 | Hpk1 antagonists and uses thereof | 20190913 |
US-2021078997-A1 | SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROL[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS | 20190913 |
US-2021078998-A1 | SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROLO[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS | 20190913 |
Complexity: | 306 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 301.04259 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 301.04259 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 47.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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