3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride
TL;DR: 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride (CAS 18705-02-7) is a chemical compound with molecular formula C21H17ClFN3O5S and molecular weight 477.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride
Also Known As: 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride, 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamin, 3-[({3-[2-(3-Chlorophenoxy)acetamido]phenyl}carbamoyl)amino]benzene-1-sulfonyl fluoride
| Molecular Formula | C21H17ClFN3O5S |
|---|---|
| Molecular Weight | 477.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.05615 |
| Heavy Atoms | 32 |
| Complexity | 750.0 |
Chemical Identifiers
| CAS Number | 18705-02-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=O)NC2=CC(=CC=C2)S(=O)(=O)F)NC(=O)COC3=CC(=CC=C3)Cl |
| InChIKey | QAPTXNNPIOOQEI-UHFFFAOYSA-N |
Product Overview
3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride (CAS 18705-02-7), with molecular formula C21H17ClFN3O5S and molecular weight 477.06 g/mol. IUPAC: 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride.
Chemical Property Profile of 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride
Property Insights of 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride
The XLogP value of 3.8 indicates that 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride. Following Lipinski's Rule of Five, 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride has 3 hydrogen bond donor(s) and 6 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 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride?
The CAS number of 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride is 18705-02-7.
What is the molecular formula of 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride?
The molecular formula of 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride is C21H17ClFN3O5S.
What is the molecular weight of 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride?
The molecular weight of 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride is 477.06 g/mol.
Where can I buy 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride?
You can request a quote for 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 3-[[3-[[2-(3-chlorophenoxy)acetyl]amino]phenyl]carbamoylamino]benzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.