CBKinase1_005232
TL;DR: CBKinase1_005232 (CAS 700855-04-5) is a chemical compound with molecular formula C20H16Cl2N4OS and molecular weight 430.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(2,5-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone
Also Known As: CBKinase1_005232, CBKinase1_017632, F3284-8586, BRD-K90377993-001-01-5, 1-[1-(2,5-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-{[1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl}ethan-1-one
| Molecular Formula | C20H16Cl2N4OS |
|---|---|
| Molecular Weight | 430.04 g/mol |
| LogP | 5.41864 |
| Topological Polar Surface Area | 52.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.04218 |
| Heavy Atoms | 28 |
| Complexity | 1198.3594 |
Chemical Identifiers
| CAS Number | 700855-04-5 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=C(C=CC(=C2)Cl)Cl)C)C(=O)CSC3=NN=C4N3C=CC=C4 |
Product Overview
CBKinase1_005232 (CAS 700855-04-5), with molecular formula C20H16Cl2N4OS and molecular weight 430.04 g/mol. IUPAC: 1-[1-(2,5-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone.
Chemical Property Profile of CBKinase1_005232
Property Insights of CBKinase1_005232
The XLogP value of 5.41864 indicates that CBKinase1_005232 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.19 Ų, CBKinase1_005232 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_005232 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_005232?
The CAS number of CBKinase1_005232 is 700855-04-5.
What is the molecular formula of CBKinase1_005232?
The molecular formula of CBKinase1_005232 is C20H16Cl2N4OS.
What is the molecular weight of CBKinase1_005232?
The molecular weight of CBKinase1_005232 is 430.04 g/mol.
Where can I buy CBKinase1_005232?
You can request a quote for CBKinase1_005232 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_005232?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_005232 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.