(R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone - CAS 131685-53-5
Catalog: |
BB007470 |
Product Name: |
(R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone |
CAS: |
131685-53-5 |
Synonyms: |
(4R)-3-(1-oxopropyl)-4-(phenylmethyl)-2-oxazolidinone; (4R)-4-benzyl-3-propanoyl-1,3-oxazolidin-2-one |
Application: |
(R)-(−)-4-Benzyl-3-propionyl-2-oxazolidinone is a oxazolidinone derivative used in the preparation of anisomycin analogues |
IUPAC Name: | (4R)-4-benzyl-3-propanoyl-1,3-oxazolidin-2-one |
Description: | (R)-4-Benzyl-3-propionyl-2-oxazolidinone (CAS# 131685-53-5) is a oxazolidinone derivative used in the preparation of anisomycin analogues. |
Molecular Weight: | 233.26 |
Molecular Formula: | C13H15NO3 |
Canonical SMILES: | CCC(=O)N1C(COC1=O)CC2=CC=CC=C2 |
InChI: | InChI=1S/C13H15NO3/c1-2-12(15)14-11(9-17-13(14)16)8-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3/t11-/m1/s1 |
InChI Key: | WHOBYFHKONUTMW-LLVKDONJSA-N |
Boiling Point: | ~396.6 °C (Predicted) / 760 mmHg |
Melting Point: | 44-46 °C |
Purity: | 99 % |
Density: | 1.21 g/mL (Predicted) |
Appearance: | Powder or crystals |
Storage: | Room temperature. |
MDL: | MFCD00269687 |
LogP: | 1.92440 |
Refractive Index: | 1.56 |
Precautionary Statement: | P261 - P305 - P351 - P338 |
Publication Number | Title | Priority Date |
KR-20210081285-A | Novel Amide Derivatives and Their Use as Inhibitors against Diacylglycerol Acyltransferase 2 | 20191223 |
WO-2021133038-A1 | Novel amide derivative useful as diacylglycerol acyltransferase 2 inhibitor, and use thereof | 20191223 |
US-2021198241-A1 | Substituted tetrahydrofurans as modulators of sodium channels | 20191206 |
WO-2021113627-A1 | Substituted tetrahydrofurans as modulators of sodium channels | 20191206 |
WO-2020260252-A1 | New macrocyclic compounds and derivatives as egfr inhibitors | 20190624 |
PMID | Publication Date | Title | Journal |
22270625 | 20111120 | A biomimetic polyketide-inspired approach to small-molecule ligand discovery | Nature chemistry |
Complexity: | 297 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.10519334 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.10519334 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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Oxazole/Thiazole
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