(2S,5R)-5-(Boc-amino)tetrahydropyran-2-carboxylic Acid - CAS 603130-13-8
Catalog: |
BB030650 |
Product Name: |
(2S,5R)-5-(Boc-amino)tetrahydropyran-2-carboxylic Acid |
CAS: |
603130-13-8 |
Synonyms: |
(2S,5R)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxanecarboxylic acid; (2S,5R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]oxane-2-carboxylic acid |
IUPAC Name: | (2S,5R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]oxane-2-carboxylic acid |
Description: | (2S,5R)-5-(Boc-amino)tetrahydropyran-2-carboxylic Acid (CAS# 603130-13-8) is aids in the synthesis of novel tetrahydropyran-based, topoisomerase inhibitors with anti-gram-positive activity. Also used in the synthesis of novel tetrahydropyran-based dipeptide isoster compounds. |
Molecular Weight: | 245.27 |
Molecular Formula: | C11H19NO5 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1CCC(OC1)C(=O)O |
InChI: | InChI=1S/C11H19NO5/c1-11(2,3)17-10(15)12-7-4-5-8(9(13)14)16-6-7/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)/t7-,8+/m1/s1 |
InChI Key: | NROSRTMHTJHLLE-SFYZADRCSA-N |
Appearance: | Pale yellow to yellow brown solid |
LogP: | 1.34770 |
Publication Number | Title | Priority Date |
WO-2021188948-A1 | Mdm2 degraders and uses thereof | 20200319 |
US-2020347043-A1 | Modulators of the integrated stress pathway | 20190430 |
WO-2020223538-A1 | Substituted cycloalkyls as modulators of the integrated stress pathway | 20190430 |
WO-2020216764-A1 | Modulators of the integrated stress response pathway | 20190423 |
WO-2020168011-A1 | Compounds, compositions and methods | 20190213 |
Complexity: | 297 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 2 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 245.12632271 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 245.12632271 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 84.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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