benzyl 5-azaspiro[2.5]octane-5-carboxylate - CAS 1454650-21-5
Catalog: |
BB009947 |
Product Name: |
benzyl 5-azaspiro[2.5]octane-5-carboxylate |
CAS: |
1454650-21-5 |
Synonyms: |
5-azaspiro[2.5]octane-5-carboxylic acid (phenylmethyl) ester; benzyl 5-azaspiro[2.5]octane-5-carboxylate |
IUPAC Name: | benzyl 5-azaspiro[2.5]octane-5-carboxylate |
Description: | benzyl 5-azaspiro[2.5]octane-5-carboxylate (CAS# 1454650-21-5) is a useful research chemical. |
Molecular Weight: | 245.322 |
Molecular Formula: | C15H19NO2 |
Canonical SMILES: | C1CC2(CC2)CN(C1)C(=O)OCC3=CC=CC=C3 |
InChI: | InChI=1S/C15H19NO2/c17-14(18-11-13-5-2-1-3-6-13)16-10-4-7-15(12-16)8-9-15/h1-3,5-6H,4,7-12H2 |
InChI Key: | RBEUYGBXYIJAEZ-UHFFFAOYSA-N |
LogP: | 3.13710 |
Publication Number | Title | Priority Date |
EP-3505171-A1 | Bicyclic nitrogenated heterocyclic compound | 20160826 |
US-2019185479-A1 | Bicyclic nitrogenated heterocyclic compound | 20160826 |
WO-2014048165-A1 | Compound as potassium channel modulator | 20120927 |
AU-2013229177-A1 | Thiazole derivatives as alpha 7 nAChR modulators | 20120306 |
AU-2013229177-B2 | Thiazole derivatives as alpha 7 nAChR modulators | 20120306 |
Complexity: | 306 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 245.141578849 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 245.141578849 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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