CBKinase1_003325
TL;DR: CBKinase1_003325 (CAS 496776-90-0) is a chemical compound with molecular formula C26H25N3O4S and molecular weight 475.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-phenylphenyl)ethanone
Also Known As: CBKinase1_003325, CBKinase1_015725, AF-399/41767581, BRD-K90763384-001-01-3, 2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-phenylphenyl)ethanone
| Molecular Formula | C26H25N3O4S |
|---|---|
| Molecular Weight | 475.16 g/mol |
| LogP | 5.1499 |
| Topological Polar Surface Area | 75.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 475.1566 |
| Heavy Atoms | 34 |
| Complexity | 1262.406 |
Chemical Identifiers
| CAS Number | 496776-90-0 |
|---|---|
| SMILES | CN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
CBKinase1_003325 (CAS 496776-90-0), with molecular formula C26H25N3O4S and molecular weight 475.16 g/mol. IUPAC: 2-[[4-methyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-phenylphenyl)ethanone.
Chemical Property Profile of CBKinase1_003325
Property Insights of CBKinase1_003325
The XLogP value of 5.1499 indicates that CBKinase1_003325 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.47 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_003325. Following Lipinski's Rule of Five, CBKinase1_003325 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_003325?
The CAS number of CBKinase1_003325 is 496776-90-0.
What is the molecular formula of CBKinase1_003325?
The molecular formula of CBKinase1_003325 is C26H25N3O4S.
What is the molecular weight of CBKinase1_003325?
The molecular weight of CBKinase1_003325 is 475.16 g/mol.
Where can I buy CBKinase1_003325?
You can request a quote for CBKinase1_003325 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003325?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003325 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.