8-Hydroxy-8-(5-methoxy-2-pyridyl)-1,4-dioxaspiro[4.5]decane - CAS 1228652-19-4
Catalog: |
BB005543 |
Product Name: |
8-Hydroxy-8-(5-methoxy-2-pyridyl)-1,4-dioxaspiro[4.5]decane |
CAS: |
1228652-19-4 |
Synonyms: |
8-(5-methoxy-2-pyridinyl)-1,4-dioxaspiro[4.5]decan-8-ol; 8-(5-methoxypyridin-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol |
IUPAC Name: | 8-(5-methoxypyridin-2-yl)-1,4-dioxaspiro[4.5]decan-8-ol |
Description: | 8-Hydroxy-8-(5-methoxy-2-pyridyl)-1,4-dioxaspiro[4.5]decane (CAS# 1228652-19-4 ) is a useful research chemical. |
Molecular Weight: | 265.30 |
Molecular Formula: | C14H19NO4 |
Canonical SMILES: | COC1=CN=C(C=C1)C2(CCC3(CC2)OCCO3)O |
InChI: | InChI=1S/C14H19NO4/c1-17-11-2-3-12(15-10-11)13(16)4-6-14(7-5-13)18-8-9-19-14/h2-3,10,16H,4-9H2,1H3 |
InChI Key: | QZVXVAAKVMVXID-UHFFFAOYSA-N |
LogP: | 1.59490 |
Publication Number | Title | Priority Date |
AU-2009324723-A1 | 4-azetidinyl-1-heteroaryl-cyclohexanol antagonists of CCR2 | 20081210 |
AU-2009324723-B2 | 4-azetidinyl-1-heteroaryl-cyclohexanol antagonists of CCR2 | 20081210 |
CA-2745969-A1 | 4-azetidinyl-1-heteroaryl-cyclohexanol antagonists of ccr2 | 20081210 |
EA-018997-B1 | CCR2 ANTAGONISTS OF 4-AZETIDINYL-1-HETEROARYL CYCLOGEXANOL GROUP | 20081210 |
EP-2376475-A1 | 4-azetidinyl-1-heteroaryl-cyclohexanol antagonists of ccr2 | 20081210 |
Complexity: | 307 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.13140809 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 60.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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