CBKinase1_006601
TL;DR: CBKinase1_006601 (CAS 706774-20-1) is a chemical compound with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-morpholin-4-ylphenyl)acetamide
Also Known As: CBKinase1_006601, CBKinase1_019001, AN-988/42466445, BRD-K72446424-001-01-9, 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-morpholin-4-ylphenyl)acetamide
| Molecular Formula | C21H22N4O3S |
|---|---|
| Molecular Weight | 410.14 g/mol |
| LogP | 3.61242 |
| Topological Polar Surface Area | 80.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.14127 |
| Heavy Atoms | 29 |
| Complexity | 968.0674 |
Chemical Identifiers
| CAS Number | 706774-20-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN=C(O2)SCC(=O)NC3=CC=CC=C3N4CCOCC4 |
Product Overview
CBKinase1_006601 (CAS 706774-20-1), with molecular formula C21H22N4O3S and molecular weight 410.14 g/mol. IUPAC: 2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(2-morpholin-4-ylphenyl)acetamide.
Chemical Property Profile of CBKinase1_006601
Property Insights of CBKinase1_006601
The XLogP value of 3.61242 indicates that CBKinase1_006601 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.49 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006601. Following Lipinski's Rule of Five, CBKinase1_006601 has 1 hydrogen bond donor(s) and 7 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_006601?
The CAS number of CBKinase1_006601 is 706774-20-1.
What is the molecular formula of CBKinase1_006601?
The molecular formula of CBKinase1_006601 is C21H22N4O3S.
What is the molecular weight of CBKinase1_006601?
The molecular weight of CBKinase1_006601 is 410.14 g/mol.
Where can I buy CBKinase1_006601?
You can request a quote for CBKinase1_006601 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006601?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006601 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.