Brl 16644
TL;DR: Brl 16644 (CAS 59257-18-0) is a chemical compound with molecular formula C22H27ClF3NO2 and molecular weight 429.16824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[2,2-dimethyl-4-[3-(trifluoromethyl)phenyl]-3,4-dihydrochromen-7-yl]oxy]-N,N-dimethylethanamine;hydrochloride
Also Known As: Brl 16644, BRL 16644 HCl, BRL-16644, (A+-)-, BRL-16644, (+/-)-, Ethanamine, N,N-dimethyl-2-((2,2-dimethyl-4-(3-(trifluoromethyl)phenyl)-3,4-dihydro-2H-1-benzopyran-7-yl)oxy)-, hydrochloride
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C22H27ClF3NO2 |
| Molecular Weight | 429.16824 g/mol |
| XLogP | 5.76 |
| Topological Polar Surface Area (TPSA) | 21.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.16824 Da |
| Heavy Atoms | 29 |
| Complexity | 509.0 |
| SMILES | CC1(CC(C2=C(O1)C=C(C=C2)OCCN(C)C)C3=CC(=CC=C3)C(F)(F)F)C.Cl |
| InChIKey | BXRCZHAPEXTREH-UHFFFAOYSA-N |
Chemical Property Profile of Brl 16644
Property Insights of Brl 16644
The XLogP value of 5.76 indicates that Brl 16644 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, Brl 16644 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Brl 16644 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Brl 16644?
The CAS number of Brl 16644 is 59257-18-0.
What is the molecular formula of Brl 16644?
The molecular formula of Brl 16644 is C22H27ClF3NO2.
What is the molecular weight of Brl 16644?
The molecular weight of Brl 16644 is 429.16824 g/mol.
Where can I buy Brl 16644?
You can request a quote for Brl 16644 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Brl 16644?
Yes, CoreyChem provides custom synthesis services for Brl 16644 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.