CBKinase1_005559
TL;DR: CBKinase1_005559 (CAS 678556-33-7) is a chemical compound with molecular formula C19H16N4OS2 and molecular weight 380.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-1-ylacetamide
Also Known As: CBKinase1_005559, CBKinase1_017959, 2-{[4-methyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide, BRD-K75438935-001-01-5, 2-(4-methyl-5-(2-thienyl)(1,2,4-triazol-3-ylthio))-N-naphthylacetamide
| Molecular Formula | C19H16N4OS2 |
|---|---|
| Molecular Weight | 380.08 g/mol |
| LogP | 4.4276 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.07657 |
| Heavy Atoms | 26 |
| Complexity | 1051.2944 |
Chemical Identifiers
| CAS Number | 678556-33-7 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC=CS4 |
Product Overview
CBKinase1_005559 (CAS 678556-33-7), with molecular formula C19H16N4OS2 and molecular weight 380.08 g/mol. IUPAC: 2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-1-ylacetamide.
Chemical Property Profile of CBKinase1_005559
Property Insights of CBKinase1_005559
The XLogP value of 4.4276 indicates that CBKinase1_005559 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, CBKinase1_005559 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_005559 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_005559?
The CAS number of CBKinase1_005559 is 678556-33-7.
What is the molecular formula of CBKinase1_005559?
The molecular formula of CBKinase1_005559 is C19H16N4OS2.
What is the molecular weight of CBKinase1_005559?
The molecular weight of CBKinase1_005559 is 380.08 g/mol.
Where can I buy CBKinase1_005559?
You can request a quote for CBKinase1_005559 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005559?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005559 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.