CBKinase1_002765
TL;DR: CBKinase1_002765 (CAS 693254-17-0) is a chemical compound with molecular formula C23H26N6O2S and molecular weight 450.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[4-methyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]acetamide
Also Known As: CBKinase1_002765, CBKinase1_015165, BRD-K06426214-001-01-6, N-[3-(4-methyl-5-{[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]acetamide, N-[3-[4-methyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]acetamide
| Molecular Formula | C23H26N6O2S |
|---|---|
| Molecular Weight | 450.18 g/mol |
| LogP | 2.8814 |
| Topological Polar Surface Area | 83.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.1838 |
| Heavy Atoms | 32 |
| Complexity | 1092.8759 |
Chemical Identifiers
| CAS Number | 693254-17-0 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC(=C1)C2=NN=C(N2C)SCC(=O)N3CCN(CC3)C4=CC=CC=C4 |
Product Overview
CBKinase1_002765 (CAS 693254-17-0), with molecular formula C23H26N6O2S and molecular weight 450.18 g/mol. IUPAC: N-[3-[4-methyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,2,4-triazol-3-yl]phenyl]acetamide.
Chemical Property Profile of CBKinase1_002765
Property Insights of CBKinase1_002765
The XLogP value of 2.8814 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_002765. The TPSA of 83.36 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_002765. Following Lipinski's Rule of Five, CBKinase1_002765 has 1 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_002765?
The CAS number of CBKinase1_002765 is 693254-17-0.
What is the molecular formula of CBKinase1_002765?
The molecular formula of CBKinase1_002765 is C23H26N6O2S.
What is the molecular weight of CBKinase1_002765?
The molecular weight of CBKinase1_002765 is 450.18 g/mol.
Where can I buy CBKinase1_002765?
You can request a quote for CBKinase1_002765 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_002765?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_002765 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.