CBKinase1_004269
TL;DR: CBKinase1_004269 (CAS 477331-52-5) is a chemical compound with molecular formula C24H20ClN5O2S and molecular weight 477.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide
Also Known As: CBKinase1_004269, CBKinase1_016669, BRD-K15797446-001-01-9, 4-[({[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide, 4-(2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)benzamide
| Molecular Formula | C24H20ClN5O2S |
|---|---|
| Molecular Weight | 477.10 g/mol |
| LogP | 4.72582 |
| Topological Polar Surface Area | 102.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 477.10263 |
| Heavy Atoms | 33 |
| Complexity | 1286.1964 |
Chemical Identifiers
| CAS Number | 477331-52-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)N)C4=CC=C(C=C4)Cl |
Product Overview
CBKinase1_004269 (CAS 477331-52-5), with molecular formula C24H20ClN5O2S and molecular weight 477.10 g/mol. IUPAC: 4-[[2-[[5-(4-chlorophenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzamide.
Chemical Property Profile of CBKinase1_004269
Property Insights of CBKinase1_004269
The XLogP value of 4.72582 indicates that CBKinase1_004269 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004269. Following Lipinski's Rule of Five, CBKinase1_004269 has 2 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_004269?
The CAS number of CBKinase1_004269 is 477331-52-5.
What is the molecular formula of CBKinase1_004269?
The molecular formula of CBKinase1_004269 is C24H20ClN5O2S.
What is the molecular weight of CBKinase1_004269?
The molecular weight of CBKinase1_004269 is 477.10 g/mol.
Where can I buy CBKinase1_004269?
You can request a quote for CBKinase1_004269 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004269?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004269 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.