4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine
TL;DR: 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine (CAS 613657-49-1) is a chemical compound with molecular formula C12H15ClFNO3S and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-chloro-4-fluorophenyl)sulfonyl-2,6-dimethylmorpholine
Also Known As: 4-((3-chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine, F1408-0082, 4-(3-chloro-4-fluorophenyl)sulfonyl-2,6-dimethylmorpholine, 4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]-2-chloro-1-fluorobenzene
| Molecular Formula | C12H15ClFNO3S |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 2.277 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.04453 |
| Heavy Atoms | 19 |
| Complexity | 568.3373 |
Chemical Identifiers
| CAS Number | 613657-49-1 |
|---|---|
| SMILES | CC1CN(CC(O1)C)S(=O)(=O)C2=CC(=C(C=C2)F)Cl |
Product Overview
4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine (CAS 613657-49-1), with molecular formula C12H15ClFNO3S and molecular weight 307.04 g/mol. IUPAC: 4-(3-chloro-4-fluorophenyl)sulfonyl-2,6-dimethylmorpholine.
Chemical Property Profile of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine
Property Insights of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine
The XLogP value of 2.277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine. With a topological polar surface area (TPSA) of 46.61 Ų, 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine?
The CAS number of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine is 613657-49-1.
What is the molecular formula of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine?
The molecular formula of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine is C12H15ClFNO3S.
What is the molecular weight of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine?
The molecular weight of 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine is 307.04 g/mol.
Where can I buy 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine?
You can request a quote for 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-((3-Chloro-4-fluorophenyl)sulfonyl)-2,6-dimethylmorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.