CBKinase1_007578
TL;DR: CBKinase1_007578 (CAS 708294-72-8) is a chemical compound with molecular formula C18H16N4O2S and molecular weight 352.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2-methylphenoxy)methyl]-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: CBKinase1_007578, CBKinase1_019978, BRD-K78250007-001-01-4, 6-[(2-methylphenoxy)methyl]-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[(2-methylphenoxy)methyl]-3-(phenoxymethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C18H16N4O2S |
|---|---|
| Molecular Weight | 352.10 g/mol |
| LogP | 3.65222 |
| Topological Polar Surface Area | 61.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 352.0994 |
| Heavy Atoms | 25 |
| Complexity | 981.0911 |
Chemical Identifiers
| CAS Number | 708294-72-8 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC2=NN3C(=NN=C3S2)COC4=CC=CC=C4 |
Product Overview
CBKinase1_007578 (CAS 708294-72-8), with molecular formula C18H16N4O2S and molecular weight 352.10 g/mol. IUPAC: 6-[(2-methylphenoxy)methyl]-3-(phenoxymethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of CBKinase1_007578
Property Insights of CBKinase1_007578
The XLogP value of 3.65222 indicates that CBKinase1_007578 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.54 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007578. Following Lipinski's Rule of Five, CBKinase1_007578 has 0 hydrogen bond donor(s) and 6 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_007578?
The CAS number of CBKinase1_007578 is 708294-72-8.
What is the molecular formula of CBKinase1_007578?
The molecular formula of CBKinase1_007578 is C18H16N4O2S.
What is the molecular weight of CBKinase1_007578?
The molecular weight of CBKinase1_007578 is 352.10 g/mol.
Where can I buy CBKinase1_007578?
You can request a quote for CBKinase1_007578 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007578?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007578 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.