CBKinase1_002596
TL;DR: CBKinase1_002596 (CAS 460321-08-8) 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.
N-(furan-2-ylmethyl)-2-[(4-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Also Known As: CBKinase1_002596, CBKinase1_014996, BAS 04454437, F1441-0756, BRD-K30754435-001-01-4
| Molecular Formula | C18H16N4O2S |
|---|---|
| Molecular Weight | 352.10 g/mol |
| LogP | 3.19242 |
| Topological Polar Surface Area | 72.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.0994 |
| Heavy Atoms | 25 |
| Complexity | 1040.0417 |
Chemical Identifiers
| CAS Number | 460321-08-8 |
|---|---|
| SMILES | CC1=CC2=CC=CC=C2N3C1=NN=C3SCC(=O)NCC4=CC=CO4 |
Product Overview
CBKinase1_002596 (CAS 460321-08-8), with molecular formula C18H16N4O2S and molecular weight 352.10 g/mol. IUPAC: N-(furan-2-ylmethyl)-2-[(4-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_002596
Property Insights of CBKinase1_002596
The XLogP value of 3.19242 indicates that CBKinase1_002596 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.43 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002596. Following Lipinski's Rule of Five, CBKinase1_002596 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_002596?
The CAS number of CBKinase1_002596 is 460321-08-8.
What is the molecular formula of CBKinase1_002596?
The molecular formula of CBKinase1_002596 is C18H16N4O2S.
What is the molecular weight of CBKinase1_002596?
The molecular weight of CBKinase1_002596 is 352.10 g/mol.
Where can I buy CBKinase1_002596?
You can request a quote for CBKinase1_002596 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002596?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002596 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.