DE(fluoro) chloroflezelastine
TL;DR: DE(fluoro) chloroflezelastine (CAS 103541-68-0) is a chemical compound with molecular formula C29H30ClN3O and molecular weight 471.20773 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-chlorophenyl)methyl]-2-[1-(2-phenylethyl)azepan-4-yl]phthalazin-1-one
Also Known As: DE(fluoro) chloroflezelastine, DE(fluoro) chloroflezelastine hydrochloride, 4-((4-(Chlorophenyl)methyl)-2-(hexahydro-1-(2-phenylethyl)-1H-azepin-4-yl)-1(2H)-phthalazinone, 4-(4-chlorobenzyl)-2-[1-(2-phenylethyl)azepan-4-yl]phthalazin-1(2h)-one, 4-[(4-chlorophenyl)methyl]-2-(1-phenethylazepan-4-yl)phthalazin-1-one
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C29H30ClN3O |
| Molecular Weight | 471.20773 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 471.20773 Da |
| Heavy Atoms | 34 |
| Complexity | 697.0 |
| SMILES | C1CC(CCN(C1)CCC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C(=N3)CC5=CC=C(C=C5)Cl |
| InChIKey | FQZPDUGONGVOMC-UHFFFAOYSA-N |
Chemical Property Profile of DE(fluoro) chloroflezelastine
Property Insights of DE(fluoro) chloroflezelastine
The XLogP value of 6.3 indicates that DE(fluoro) chloroflezelastine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, DE(fluoro) chloroflezelastine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, DE(fluoro) chloroflezelastine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of DE(fluoro) chloroflezelastine?
The CAS number of DE(fluoro) chloroflezelastine is 103541-68-0.
What is the molecular formula of DE(fluoro) chloroflezelastine?
The molecular formula of DE(fluoro) chloroflezelastine is C29H30ClN3O.
What is the molecular weight of DE(fluoro) chloroflezelastine?
The molecular weight of DE(fluoro) chloroflezelastine is 471.20773 g/mol.
Where can I buy DE(fluoro) chloroflezelastine?
You can request a quote for DE(fluoro) chloroflezelastine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for DE(fluoro) chloroflezelastine?
Yes, CoreyChem provides custom synthesis services for DE(fluoro) chloroflezelastine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.