1-tert-butyl 2-methyl 5-hydroxypiperidine-1,2-dicarboxylate - CAS 1822538-74-8
Catalog: |
BB013892 |
Product Name: |
1-tert-butyl 2-methyl 5-hydroxypiperidine-1,2-dicarboxylate |
CAS: |
1822538-74-8 |
Synonyms: |
5-hydroxypiperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester; 1-O-tert-butyl 2-O-methyl 5-hydroxypiperidine-1,2-dicarboxylate |
IUPAC Name: | 1-O-tert-butyl 2-O-methyl 5-hydroxypiperidine-1,2-dicarboxylate |
Description: | 1-tert-butyl 2-methyl 5-hydroxypiperidine-1,2-dicarboxylate (CAS# 1822538-74-8 ) is a useful research chemical. |
Molecular Weight: | 259.302 |
Molecular Formula: | C12H21NO5 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CC(CCC1C(=O)OC)O |
InChI: | InChI=1S/C12H21NO5/c1-12(2,3)18-11(16)13-7-8(14)5-6-9(13)10(15)17-4/h8-9,14H,5-7H2,1-4H3 |
InChI Key: | SCKQPFVBRJQINF-UHFFFAOYSA-N |
LogP: | 0.85770 |
Publication Number | Title | Priority Date |
US-2020361898-A1 | Nlrp3 inflammasome inhibitors | 20190517 |
US-2020361899-A1 | Nlrp3 inflammasome inhibitors | 20190517 |
WO-2020234715-A1 | Nlrp3 inflammasome inhibitors | 20190517 |
JP-2019530650-A | Amino-pyrrolopyrimidinone compounds and methods of use thereof | 20160824 |
KR-20190035925-A | Amino-pyrrolopyrimidine compounds and methods for their use | 20160824 |
Complexity: | 323 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 259.14197277 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 259.14197277 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 76.1 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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