![1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea structure](/static/products/6051/60515-82-4.webp)
1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea
TL;DR: 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea (CAS 60515-82-4) is a chemical compound with molecular formula C15H14ClN3O5S and molecular weight 383.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea
Also Known As: 1-(2-chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea, 4-Nitro-4'-chloroethylaminocarbonylaminediphenylsulfone, N-(2-Chloroethyl)-N'-[4-(4-nitrobenzene-1-sulfonyl)phenyl]urea
| Molecular Formula | C15H14ClN3O5S |
|---|---|
| Molecular Weight | 383.03 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.03427 |
| Heavy Atoms | 25 |
| Complexity | 559.0 |
Chemical Identifiers
| CAS Number | 60515-82-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)NCCCl)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | IOTUAVRBKYXEJE-UHFFFAOYSA-N |
Product Overview
1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea (CAS 60515-82-4), with molecular formula C15H14ClN3O5S and molecular weight 383.03 g/mol. IUPAC: 1-(2-chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea.
Chemical Property Profile of 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea
Property Insights of 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea. Following Lipinski's Rule of Five, 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea has 2 hydrogen bond donor(s) and 5 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 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea?
The CAS number of 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea is 60515-82-4.
What is the molecular formula of 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea?
The molecular formula of 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea is C15H14ClN3O5S.
What is the molecular weight of 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea?
The molecular weight of 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea is 383.03 g/mol.
Where can I buy 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea?
You can request a quote for 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloroethyl)-3-[4-(4-nitrophenyl)sulfonylphenyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.