R-95845
TL;DR: R-95845 (CAS 163435-77-6) is a chemical compound with molecular formula C17H16Br2N2O2 and molecular weight 437.95786 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(2-acetyl-5-methylanilino)-2-(2,6-dibromophenyl)acetamide
Also Known As: PhNH-PhAcNH deriv., .alpha.-APA deriv., 2,6-Dibromo-alpha-APA, R-95845, R 95845
Technical Specifications
| Molecular Formula | C17H16Br2N2O2 |
| Molecular Weight | 437.95786 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.95786 Da |
| Heavy Atoms | 23 |
| Complexity | 436.0 |
| SMILES | CC1=CC(=C(C=C1)C(=O)C)N[C@@H](C2=C(C=CC=C2Br)Br)C(=O)N |
| InChIKey | FELUFXCUIYHAPB-INIZCTEOSA-N |
Chemical Property Profile of R-95845
Property Insights of R-95845
The XLogP value of 4.5 indicates that R-95845 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for R-95845. Following Lipinski's Rule of Five, R-95845 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of R-95845?
The CAS number of R-95845 is 163435-77-6.
What is the molecular formula of R-95845?
The molecular formula of R-95845 is C17H16Br2N2O2.
What is the molecular weight of R-95845?
The molecular weight of R-95845 is 437.95786 g/mol.
Where can I buy R-95845?
You can request a quote for R-95845 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for R-95845?
Yes, CoreyChem provides custom synthesis services for R-95845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.