CBKinase1_011708
TL;DR: CBKinase1_011708 (CAS 831240-33-6) is a chemical compound with molecular formula C25H32N4O2S and molecular weight 452.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]-4-piperidin-1-ylpiperidine-4-carboxamide
Also Known As: CBKinase1_011708, CBKinase1_024108, ZINC 01063940, BRD-K98134241-001-01-2, 1-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]-4-piperidin-1-ylpiperidine-4-carboxamide
| Molecular Formula | C25H32N4O2S |
|---|---|
| Molecular Weight | 452.22 g/mol |
| LogP | 3.5821 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.2246 |
| Heavy Atoms | 32 |
| Complexity | 922.54895 |
Chemical Identifiers
| CAS Number | 831240-33-6 |
|---|---|
| SMILES | C1CCN(CC1)C2(CCN(CC2)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C(=O)N |
Product Overview
CBKinase1_011708 (CAS 831240-33-6), with molecular formula C25H32N4O2S and molecular weight 452.22 g/mol. IUPAC: 1-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]-4-piperidin-1-ylpiperidine-4-carboxamide.
Chemical Property Profile of CBKinase1_011708
Property Insights of CBKinase1_011708
The XLogP value of 3.5821 indicates that CBKinase1_011708 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011708. Following Lipinski's Rule of Five, CBKinase1_011708 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_011708?
The CAS number of CBKinase1_011708 is 831240-33-6.
What is the molecular formula of CBKinase1_011708?
The molecular formula of CBKinase1_011708 is C25H32N4O2S.
What is the molecular weight of CBKinase1_011708?
The molecular weight of CBKinase1_011708 is 452.22 g/mol.
Where can I buy CBKinase1_011708?
You can request a quote for CBKinase1_011708 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011708?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011708 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.