8L-947
TL;DR: 8L-947 (CAS 339101-82-5) is a chemical compound with molecular formula C25H23Cl2N3O4S and molecular weight 531.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[2-[(4-chlorophenyl)sulfonylmethyl]-4-(pyrrolidine-1-carbonyl)phenyl]urea
Also Known As: 8L-947, N-(4-chlorophenyl)-N'-[2-{[(4-chlorophenyl)sulfonyl]methyl}-4-(1-pyrrolidinylcarbonyl)phenyl]urea, 1-(4-chlorophenyl)-3-[2-[(4-chlorophenyl)sulfonylmethyl]-4-(pyrrolidine-1-carbonyl)phenyl]urea, 3-{2-[(4-chlorobenzenesulfonyl)methyl]-4-(pyrrolidine-1-carbonyl)phenyl}-1-(4-chlorophenyl)urea, 3-(4-chlorophenyl)-1-[2-[(4-chlorophenyl)sulfonylmethyl]-4-(pyrrolidine-1-carbonyl)phenyl]urea
| Molecular Formula | C25H23Cl2N3O4S |
|---|---|
| Molecular Weight | 531.08 g/mol |
| LogP | 5.8473 |
| Topological Polar Surface Area | 95.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 531.0786 |
| Heavy Atoms | 35 |
| Complexity | 1338.1299 |
Chemical Identifiers
| CAS Number | 339101-82-5 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=CC(=C(C=C2)NC(=O)NC3=CC=C(C=C3)Cl)CS(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
8L-947 (CAS 339101-82-5), with molecular formula C25H23Cl2N3O4S and molecular weight 531.08 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[2-[(4-chlorophenyl)sulfonylmethyl]-4-(pyrrolidine-1-carbonyl)phenyl]urea.
Chemical Property Profile of 8L-947
Property Insights of 8L-947
The XLogP value of 5.8473 indicates that 8L-947 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 8L-947. Following Lipinski's Rule of Five, 8L-947 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8L-947?
The CAS number of 8L-947 is 339101-82-5.
What is the molecular formula of 8L-947?
The molecular formula of 8L-947 is C25H23Cl2N3O4S.
What is the molecular weight of 8L-947?
The molecular weight of 8L-947 is 531.08 g/mol.
Where can I buy 8L-947?
You can request a quote for 8L-947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8L-947?
Yes, KEHONG BIO provides custom synthesis services for 8L-947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.