CBKinase1_007789
TL;DR: CBKinase1_007789 (CAS 708997-25-5) is a chemical compound with molecular formula C16H13N5O2S and molecular weight 339.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole
Also Known As: CBKinase1_007789, CBKinase1_020189, BAS 08196879, AN-023/42555904, 5-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole
| Molecular Formula | C16H13N5O2S |
|---|---|
| Molecular Weight | 339.08 g/mol |
| LogP | 3.4174 |
| Topological Polar Surface Area | 82.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.079 |
| Heavy Atoms | 24 |
| Complexity | 930.7148 |
Chemical Identifiers
| CAS Number | 708997-25-5 |
|---|---|
| SMILES | CN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3)C4=CC=CO4 |
Product Overview
CBKinase1_007789 (CAS 708997-25-5), with molecular formula C16H13N5O2S and molecular weight 339.08 g/mol. IUPAC: 5-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-3-phenyl-1,2,4-oxadiazole.
Chemical Property Profile of CBKinase1_007789
Property Insights of CBKinase1_007789
The XLogP value of 3.4174 indicates that CBKinase1_007789 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.77 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_007789. Following Lipinski's Rule of Five, CBKinase1_007789 has 0 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_007789?
The CAS number of CBKinase1_007789 is 708997-25-5.
What is the molecular formula of CBKinase1_007789?
The molecular formula of CBKinase1_007789 is C16H13N5O2S.
What is the molecular weight of CBKinase1_007789?
The molecular weight of CBKinase1_007789 is 339.08 g/mol.
Where can I buy CBKinase1_007789?
You can request a quote for CBKinase1_007789 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_007789?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_007789 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.