Methyl endo-8-Boc-8-azabicyclo[3.2.1]octane-3-carboxylate - CAS 1548548-51-1
Catalog: |
BB011063 |
Product Name: |
Methyl endo-8-Boc-8-azabicyclo[3.2.1]octane-3-carboxylate |
CAS: |
1548548-51-1 |
Synonyms: |
(1R,5S)-8-azabicyclo[3.2.1]octane-3,8-dicarboxylic acid O8-tert-butyl ester O3-methyl ester; 8-O-tert-butyl 3-O-methyl (1R,5S)-8-azabicyclo[3.2.1]octane-3,8-dicarboxylate |
IUPAC Name: | 8-O-tert-butyl 3-O-methyl (1S,5R)-8-azabicyclo[3.2.1]octane-3,8-dicarboxylate |
Description: | Methyl endo-8-Boc-8-azabicyclo[3.2.1]octane-3-carboxylate (CAS# 1548548-51-1 ) is a useful research chemical. |
Molecular Weight: | 269.34 |
Molecular Formula: | C14H23NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)N1C2CCC1CC(C2)C(=O)OC |
InChI: | InChI=1S/C14H23NO4/c1-14(2,3)19-13(17)15-10-5-6-11(15)8-9(7-10)12(16)18-4/h9-11H,5-8H2,1-4H3/t9?,10-,11+ |
InChI Key: | AMBCTFGOVMCGIL-FGWVZKOKSA-N |
LogP: | 2.27540 |
Publication Number | Title | Priority Date |
US-2020317665-A1 | Protein tyrosine phosphatase inhibitors | 20190402 |
EP-3250204-B1 | Inhibitors of the renal outer medullary potassium channel | 20150129 |
US-2018009807-A1 | Inhibitors of the renal outer medullary potassium channel | 20150129 |
EP-2968288-B1 | Inhibitors of the renal outer medullary potassium channel | 20130315 |
US-2016024091-A1 | Inhibitors of the renal outer medullary potassium channel | 20130315 |
Complexity: | 360 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 269.16270821 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 269.16270821 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 55.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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