(4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine
TL;DR: (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine (CAS 70287-40-0) is a chemical compound with molecular formula C11H15NO and molecular weight 177.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine
Also Known As: CC1N(C)COC1c2ccccc2, INDICINE-N-OXIDE DERIV (+), Oxazolidine,4-dimethyl-5-phenyl-, cis-, (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine, Oxazolidine,4-dimethyl-5-phenyl-, (4R-cis)-
| Molecular Formula | C11H15NO |
|---|---|
| Molecular Weight | 177.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.11537 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 70287-40-0 |
|---|---|
| SMILES | C[C@@H]1[C@@H](OCN1C)C2=CC=CC=C2 |
| InChIKey | POZQVPIDBKNJTK-MWLCHTKSSA-N |
Product Overview
(4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine (CAS 70287-40-0), with molecular formula C11H15NO and molecular weight 177.12 g/mol. IUPAC: (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine.
Chemical Property Profile of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine
Property Insights of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine. With a topological polar surface area (TPSA) of 12.5 Ų, (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine?
The CAS number of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine is 70287-40-0.
What is the molecular formula of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine?
The molecular formula of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine is C11H15NO.
What is the molecular weight of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine?
The molecular weight of (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine is 177.12 g/mol.
Where can I buy (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine?
You can request a quote for (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine?
Yes, KEHONG BIO provides custom synthesis services for (4R,5S)-3,4-dimethyl-5-phenyl-1,3-oxazolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.