CBKinase1_011601
TL;DR: CBKinase1_011601 (CAS 767326-46-5) is a chemical compound with molecular formula C20H21FN4O2S and molecular weight 400.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-ethyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-5-methylphenyl)acetamide
Also Known As: CBKinase1_011601, CBKinase1_024001, BRD-K35658857-001-01-1, 2-{[4-ethyl-5-(2-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide, 2-[[4-ethyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-5-methylphenyl)acetamide
| Molecular Formula | C20H21FN4O2S |
|---|---|
| Molecular Weight | 400.14 g/mol |
| LogP | 4.15192 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 400.13693 |
| Heavy Atoms | 28 |
| Complexity | 990.0871 |
Chemical Identifiers
| CAS Number | 767326-46-5 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C)OC)C3=CC=CC=C3F |
Product Overview
CBKinase1_011601 (CAS 767326-46-5), with molecular formula C20H21FN4O2S and molecular weight 400.14 g/mol. IUPAC: 2-[[4-ethyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxy-5-methylphenyl)acetamide.
Chemical Property Profile of CBKinase1_011601
Property Insights of CBKinase1_011601
The XLogP value of 4.15192 indicates that CBKinase1_011601 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011601. Following Lipinski's Rule of Five, CBKinase1_011601 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_011601?
The CAS number of CBKinase1_011601 is 767326-46-5.
What is the molecular formula of CBKinase1_011601?
The molecular formula of CBKinase1_011601 is C20H21FN4O2S.
What is the molecular weight of CBKinase1_011601?
The molecular weight of CBKinase1_011601 is 400.14 g/mol.
Where can I buy CBKinase1_011601?
You can request a quote for CBKinase1_011601 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011601?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011601 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.