CBKinase1_009941
TL;DR: CBKinase1_009941 (CAS 714204-79-2) is a chemical compound with molecular formula C18H22N2O4S2 and molecular weight 394.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxy-3-methylphenyl)sulfonyl-methylamino]-N-(3-methylsulfanylphenyl)acetamide
Also Known As: CBKinase1_009941, CBKinase1_022341, BRD-K99972023-001-01-8, 2-[(4-methoxy-3-methylphenyl)sulfonyl-methylamino]-N-(3-methylsulfanylphenyl)acetamide, N~2~-[(4-methoxy-3-methylphenyl)sulfonyl]-N~2~-methyl-N-[3-(methylsulfanyl)phenyl]glycinamide
| Molecular Formula | C18H22N2O4S2 |
|---|---|
| Molecular Weight | 394.10 g/mol |
| LogP | 2.98472 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.1021 |
| Heavy Atoms | 26 |
| Complexity | 897.81415 |
Chemical Identifiers
| CAS Number | 714204-79-2 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)N(C)CC(=O)NC2=CC(=CC=C2)SC)OC |
Product Overview
CBKinase1_009941 (CAS 714204-79-2), with molecular formula C18H22N2O4S2 and molecular weight 394.10 g/mol. IUPAC: 2-[(4-methoxy-3-methylphenyl)sulfonyl-methylamino]-N-(3-methylsulfanylphenyl)acetamide.
Chemical Property Profile of CBKinase1_009941
Property Insights of CBKinase1_009941
The XLogP value of 2.98472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_009941. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_009941. Following Lipinski's Rule of Five, CBKinase1_009941 has 1 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 CBKinase1_009941?
The CAS number of CBKinase1_009941 is 714204-79-2.
What is the molecular formula of CBKinase1_009941?
The molecular formula of CBKinase1_009941 is C18H22N2O4S2.
What is the molecular weight of CBKinase1_009941?
The molecular weight of CBKinase1_009941 is 394.10 g/mol.
Where can I buy CBKinase1_009941?
You can request a quote for CBKinase1_009941 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_009941?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_009941 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.