![4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride structure](/static/products/140/14023-02-0.png)
4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride
TL;DR: 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride (CAS 14023-02-0) is a chemical compound with molecular formula C9H9ClFN3O4S and molecular weight 309.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride
Also Known As: 1,3-Bis-(2-chlor-1,1-dimethylethyl)-harnstoff, 4-(3-(2-chloroethyl)-3-nitrosoureido)benzenesulfonyl fluoride, 4-{[(2-chloroethyl)(nitroso)carbamoyl]amino}benzenesulfonyl fluoride, 4-[[2-chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride, 4-{[(2-Chloroethyl)(nitroso)carbamoyl]amino}benzene-1-sulfonyl fluoride
| Molecular Formula | C9H9ClFN3O4S |
|---|---|
| Molecular Weight | 309.00 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.99863 |
| Heavy Atoms | 19 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 14023-02-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)N(CCCl)N=O)S(=O)(=O)F |
| InChIKey | SUUDTAKROFWZHO-UHFFFAOYSA-N |
Product Overview
4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride (CAS 14023-02-0), with molecular formula C9H9ClFN3O4S and molecular weight 309.00 g/mol. IUPAC: 4-[[2-chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride.
Chemical Property Profile of 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride
Property Insights of 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride. Following Lipinski's Rule of Five, 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride has 1 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 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride?
The CAS number of 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride is 14023-02-0.
What is the molecular formula of 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride?
The molecular formula of 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride is C9H9ClFN3O4S.
What is the molecular weight of 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride?
The molecular weight of 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride is 309.00 g/mol.
Where can I buy 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride?
You can request a quote for 4-[[2-Chloroethyl(nitroso)carbamoyl]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-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 4-[[2-Chloroethyl(nitroso)carbamoyl]amino]benzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.