3,3-Dimethyl-1,5-dioxa-9-azaspiro[5.5]undecane - CAS 65535-86-6
Catalog: |
BB055903 |
Product Name: |
3,3-Dimethyl-1,5-dioxa-9-azaspiro[5.5]undecane |
CAS: |
65535-86-6 |
Synonyms: |
3,3-dimethyl-1,5-dioxa-9-azaspiro[5.5]undecane |
IUPAC Name: | 3,3-dimethyl-1,5-dioxa-9-azaspiro[5.5]undecane |
Description: | 3,3-Dimethyl-1,5-dioxa-9-azaspiro[5.5]undecane can be useful in the preparation of pyrazolo[1,5-a]pyridinecarbonyl-substituted spirocyclic piperidine ketals as inhibitors of HCV protein NS4B. |
Molecular Weight: | 185.26 |
Molecular Formula: | C10H19NO2 |
Canonical SMILES: | CC1(COC2(CCNCC2)OC1)C |
InChI: | InChI=1S/C10H19NO2/c1-9(2)7-12-10(13-8-9)3-5-11-6-4-10/h11H,3-8H2,1-2H3 |
InChI Key: | YLYCRECLQBDSHW-UHFFFAOYSA-N |
References: | Tai, V. W.-F., et al. Bioorg. Med. Chem. Lett., 24, 2288 (2014). |
Complexity: | 173 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.141578849 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.141578849 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 30.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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