(S)-5-(Boc-amino)tetrahydropyran-2-one - CAS 125982-23-2
Catalog: |
BB006286 |
Product Name: |
(S)-5-(Boc-amino)tetrahydropyran-2-one |
CAS: |
125982-23-2 |
Synonyms: |
N-(6-oxo-3-oxanyl)carbamic acid tert-butyl ester; tert-butyl N-(6-oxooxan-3-yl)carbamate |
IUPAC Name: | tert-butyl N-[(3S)-6-oxooxan-3-yl]carbamate |
Description: | (S)-5-(Boc-amino)tetrahydropyran-2-one (CAS# 125982-23-2 ) is a useful research chemical. |
Molecular Weight: | 215.25 |
Molecular Formula: | C10H17NO4 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1CCC(=O)OC1 |
InChI: | InChI=1S/C10H17NO4/c1-10(2,3)15-9(13)11-7-4-5-8(12)14-6-7/h7H,4-6H2,1-3H3,(H,11,13) |
InChI Key: | NIZFUEFAOHKWFS-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 ℃ |
LogP: | 1.60760 |
Publication Number | Title | Priority Date |
US-2019256523-A1 | Novel jak1 selective inhibitors and uses thereof | 20161003 |
WO-2018067422-A1 | Novel jak1 selective inhibitors and uses thereof | 20161003 |
US-10738060-B2 | JAK1 selective inhibitors and uses thereof | 20161003 |
AU-2015253192-A1 | Processes of preparing a JAK1 inhibitor and new forms thereto | 20140430 |
AU-2015253192-B2 | Processes of preparing a JAK1 inhibitor and new forms thereto | 20140430 |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.11575802 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.11575802 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 64.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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