RefChem:909116
TL;DR: RefChem:909116 (CAS 162793-63-7) is a chemical compound with molecular formula C21H11Cl3F6N2O5S and molecular weight 621.93585 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5-dichloro-2-[2-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-4-(trifluoromethyl)phenoxy]benzenesulfonic acid
Also Known As: SKF 45905, SK&F-45905, SK&F45905, SK&F 45905, SID:99222719
Technical Specifications
| Molecular Formula | C21H11Cl3F6N2O5S |
| Molecular Weight | 621.93585 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 621.93585 Da |
| Heavy Atoms | 38 |
| Complexity | 938.0 |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)OC3=CC(=C(C=C3S(=O)(=O)O)Cl)Cl |
| InChIKey | HZCUOEVEYNOQRW-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:909116
Property Insights of RefChem:909116
The XLogP value of 6.4 indicates that RefChem:909116 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:909116. Following Lipinski's Rule of Five, RefChem:909116 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:909116?
The CAS number of RefChem:909116 is 162793-63-7.
What is the molecular formula of RefChem:909116?
The molecular formula of RefChem:909116 is C21H11Cl3F6N2O5S.
What is the molecular weight of RefChem:909116?
The molecular weight of RefChem:909116 is 621.93585 g/mol.
Where can I buy RefChem:909116?
You can request a quote for RefChem:909116 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:909116?
Yes, CoreyChem provides custom synthesis services for RefChem:909116 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.