7-Boc-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylic Acid - CAS 885281-30-1
Catalog: |
BB038954 |
Product Name: |
7-Boc-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylic Acid |
CAS: |
885281-30-1 |
Synonyms: |
7-[(2-methylpropan-2-yl)oxy-oxomethyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid; 7-[(2-methylpropan-2-yl)oxycarbonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid |
IUPAC Name: | 7-[(2-methylpropan-2-yl)oxycarbonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid |
Description: | 7-Boc-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylic Acid (CAS# 885281-30-1) is a useful research chemical. |
Molecular Weight: | 267.28 |
Molecular Formula: | C12H17N3O4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCN2C=C(N=C2C1)C(=O)O |
InChI: | InChI=1S/C12H17N3O4/c1-12(2,3)19-11(18)15-5-4-14-6-8(10(16)17)13-9(14)7-15/h6H,4-5,7H2,1-3H3,(H,16,17) |
InChI Key: | YUBMPMRXTOOBIU-UHFFFAOYSA-N |
Boiling Point: | 502.8 °C at 760 mmHg |
Density: | 1.36 g/cm3 |
LogP: | 1.26990 |
Publication Number | Title | Priority Date |
WO-2019192506-A1 | Immunomodulators, compositions and methods thereof | 20180403 |
CN-111936475-A | Immunomodulator, composition and preparation method thereof | 20180403 |
EP-3774750-A1 | Immunomodulators, compositions and methods thereof | 20180403 |
KR-20210010979-A | Immunomodulatory agents, compositions and methods thereof | 20180403 |
US-2021040118-A1 | Immunomodulators, compositions and methods thereof | 20180403 |
Complexity: | 380 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 267.12190603 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 267.12190603 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 84.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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