(S,S)-N-(1-Phenylethyl) Ibuprofen Amide
TL;DR: (S,S)-N-(1-Phenylethyl) Ibuprofen Amide (CAS 105959-56-6) is a chemical compound with molecular formula C21H27NO and molecular weight 309.20926 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-[4-(2-methylpropyl)phenyl]-N-[(1S)-1-phenylethyl]propanamide
Also Known As: (alphaS)-, Ibuprofen Impurity 39, Ibuprofen Impurity 93, (R,R)-N-(1-Phenylethyl) Ibuprofen Amide, (S,S)-N-(1-Phenylethyl) Ibuprofen Amide
Technical Specifications
| Molecular Formula | C21H27NO |
| Molecular Weight | 309.20926 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 309.20926 Da |
| Heavy Atoms | 23 |
| Complexity | 351.0 |
| SMILES | C[C@@H](C1=CC=C(C=C1)CC(C)C)C(=O)N[C@@H](C)C2=CC=CC=C2 |
| InChIKey | BLNIYEIMTLMHGY-IRXDYDNUSA-N |
Chemical Property Profile of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide
Property Insights of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide
The XLogP value of 5.2 indicates that (S,S)-N-(1-Phenylethyl) Ibuprofen Amide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, (S,S)-N-(1-Phenylethyl) Ibuprofen Amide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S,S)-N-(1-Phenylethyl) Ibuprofen Amide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide?
The CAS number of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide is 105959-56-6.
What is the molecular formula of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide?
The molecular formula of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide is C21H27NO.
What is the molecular weight of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide?
The molecular weight of (S,S)-N-(1-Phenylethyl) Ibuprofen Amide is 309.20926 g/mol.
Where can I buy (S,S)-N-(1-Phenylethyl) Ibuprofen Amide?
You can request a quote for (S,S)-N-(1-Phenylethyl) Ibuprofen Amide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S,S)-N-(1-Phenylethyl) Ibuprofen Amide?
Yes, CoreyChem provides custom synthesis services for (S,S)-N-(1-Phenylethyl) Ibuprofen Amide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.