![4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride structure](/static/products/2131/21315-95-7.webp)
4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride
TL;DR: 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride (CAS 21315-95-7) is a chemical compound with molecular formula C14H11FN2O6S and molecular weight 354.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-(4-nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride
Also Known As: 4-butylaminocoumarin, starbld0019144, 4-{[(4-nitrophenoxy)acetyl]amino}benzenesulfonyl fluoride, 4-(2-(4-Nitrophenoxy)acetamido)benzene-1-sulfonyl fluoride, 4-[[2-(4-nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride
| Molecular Formula | C14H11FN2O6S |
|---|---|
| Molecular Weight | 354.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.0322 |
| Heavy Atoms | 24 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 21315-95-7 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)F |
| InChIKey | QFJAFIJDZVWTAB-UHFFFAOYSA-N |
Product Overview
4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride (CAS 21315-95-7), with molecular formula C14H11FN2O6S and molecular weight 354.03 g/mol. IUPAC: 4-[[2-(4-nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride.
Chemical Property Profile of 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride
Property Insights of 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride. Following Lipinski's Rule of Five, 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride has 1 hydrogen bond donor(s) and 7 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-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride?
The CAS number of 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride is 21315-95-7.
What is the molecular formula of 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride?
The molecular formula of 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride is C14H11FN2O6S.
What is the molecular weight of 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride?
The molecular weight of 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride is 354.03 g/mol.
Where can I buy 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride?
You can request a quote for 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 4-[[2-(4-Nitrophenoxy)acetyl]amino]benzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.