CBKinase1_011867
TL;DR: CBKinase1_011867 (CAS 832681-23-9) is a chemical compound with molecular formula C20H22BrN3O4S and molecular weight 479.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-bromophenyl)sulfonyl-methylamino]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide
Also Known As: CBKinase1_011867, CBKinase1_024267, BRD-K74385024-001-01-1, 2-[(4-bromophenyl)sulfonyl-methylamino]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide, N~2~-[(4-bromophenyl)sulfonyl]-N~2~-methyl-N-[2-(pyrrolidin-1-ylcarbonyl)phenyl]glycinamide
| Molecular Formula | C20H22BrN3O4S |
|---|---|
| Molecular Weight | 479.05 g/mol |
| LogP | 2.9443 |
| Topological Polar Surface Area | 86.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.05145 |
| Heavy Atoms | 29 |
| Complexity | 1002.6413 |
Chemical Identifiers
| CAS Number | 832681-23-9 |
|---|---|
| SMILES | CN(CC(=O)NC1=CC=CC=C1C(=O)N2CCCC2)S(=O)(=O)C3=CC=C(C=C3)Br |
Product Overview
CBKinase1_011867 (CAS 832681-23-9), with molecular formula C20H22BrN3O4S and molecular weight 479.05 g/mol. IUPAC: 2-[(4-bromophenyl)sulfonyl-methylamino]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide.
Chemical Property Profile of CBKinase1_011867
Property Insights of CBKinase1_011867
The XLogP value of 2.9443 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_011867. The TPSA of 86.79 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011867. Following Lipinski's Rule of Five, CBKinase1_011867 has 1 hydrogen bond donor(s) and 4 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 CBKinase1_011867?
The CAS number of CBKinase1_011867 is 832681-23-9.
What is the molecular formula of CBKinase1_011867?
The molecular formula of CBKinase1_011867 is C20H22BrN3O4S.
What is the molecular weight of CBKinase1_011867?
The molecular weight of CBKinase1_011867 is 479.05 g/mol.
Where can I buy CBKinase1_011867?
You can request a quote for CBKinase1_011867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011867?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.