4-(Boc-amino)-2-chloro-3-pyridinecarbaldehyde - CAS 893423-62-6
Catalog: |
BB039429 |
Product Name: |
4-(Boc-amino)-2-chloro-3-pyridinecarbaldehyde |
CAS: |
893423-62-6 |
Synonyms: |
N-(2-chloro-3-formyl-4-pyridinyl)carbamic acid tert-butyl ester; tert-butyl N-(2-chloro-3-formylpyridin-4-yl)carbamate |
IUPAC Name: | tert-butyl N-(2-chloro-3-formylpyridin-4-yl)carbamate |
Description: | 4-(Boc-amino)-2-chloro-3-pyridinecarbaldehyde (CAS# 893423-62-6) is used as a reagent in the synthesis of naphthyridinones as allosteric dual Akt1 and Akt2 inhibitors. |
Molecular Weight: | 256.69 |
Molecular Formula: | C11H13ClN2O3 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=C(C(=NC=C1)Cl)C=O |
InChI: | InChI=1S/C11H13ClN2O3/c1-11(2,3)17-10(16)14-8-4-5-13-9(12)7(8)6-15/h4-6H,1-3H3,(H,13,14,16) |
InChI Key: | YNHFPXDHWTUUCL-UHFFFAOYSA-N |
Appearance: | Solid |
LogP: | 2.96750 |
Publication Number | Title | Priority Date |
WO-2013009535-A1 | Il-23 antagonists for treatment or prevention of skin rash associated with treatment with p13k/akt pathway inhibitors | 20110708 |
US-2013287763-A1 | Combination therapy for treating cancer comprising an igf-1r inhibitor and an akt inhibitor | 20100728 |
WO-2012015741-A2 | Combination therapy for treating cancer comprising an igf-1r inhibitor and an akt inhibitor | 20100728 |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
US-2013281324-A1 | Bi-functinal complexes and methods for making and using such complexes | 20100416 |
Complexity: | 291 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 256.06147 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 256.06147 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 68.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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