6-(Boc-amino)pyridine-3-boronic Acid - CAS 883231-20-7
Catalog: |
BB038819 |
Product Name: |
6-(Boc-amino)pyridine-3-boronic Acid |
CAS: |
883231-20-7 |
Synonyms: |
[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyridinyl]boronic acid; [6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid |
IUPAC Name: | [6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid |
Description: | 6-(Boc-amino)pyridine-3-boronic Acid (CAS# 883231-20-7) is a useful research chemical. |
Molecular Weight: | 238.05 |
Molecular Formula: | C10H15N2O4B |
Canonical SMILES: | B(C1=CN=C(C=C1)NC(=O)OC(C)(C)C)(O)O |
InChI: | InChI=1S/C10H15BN2O4/c1-10(2,3)17-9(14)13-8-5-4-7(6-12-8)11(15)16/h4-6,15-16H,1-3H3,(H,12,13,14) |
InChI Key: | KAFAFKANQAGBRH-UHFFFAOYSA-N |
Appearance: | Solid |
MDL: | MFCD11975411 |
LogP: | 0.18140 |
Publication Number | Title | Priority Date |
CN-110845476-A | High-selectivity CSF1R inhibitor, preparation method and pharmaceutical application thereof | 20180821 |
JP-2018531918-A | Hepatitis B virus core protein modulator | 20150915 |
KR-20180053363-A | Hepatitis B core protein modulator | 20150915 |
US-10377748-B2 | Hepatitis B core protein modulators | 20150915 |
US-2018258084-A1 | Hepatitis b core protein modulators | 20150915 |
Complexity: | 268 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.1124871 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.1124871 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 91.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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