CBKinase1_003740
TL;DR: CBKinase1_003740 (CAS 442865-43-2) is a chemical compound with molecular formula C20H14ClF3N4OS and molecular weight 450.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide
Also Known As: CBKinase1_003740, CBKinase1_016140, F1174-1157, BRD-K17778732-001-01-0, N-[4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL]-2-({5-METHYL-[1,2,4]TRIAZOLO[4,3-A]QUINOLIN-1-YL}SULFANYL)ACETAMIDE
| Molecular Formula | C20H14ClF3N4OS |
|---|---|
| Molecular Weight | 450.05 g/mol |
| LogP | 5.59392 |
| Topological Polar Surface Area | 59.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.0529 |
| Heavy Atoms | 30 |
| Complexity | 1272.3601 |
Chemical Identifiers
| CAS Number | 442865-43-2 |
|---|---|
| SMILES | CC1=CC2=NN=C(N2C3=CC=CC=C13)SCC(=O)NC4=CC(=C(C=C4)Cl)C(F)(F)F |
Product Overview
CBKinase1_003740 (CAS 442865-43-2), with molecular formula C20H14ClF3N4OS and molecular weight 450.05 g/mol. IUPAC: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(5-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetamide.
Chemical Property Profile of CBKinase1_003740
Property Insights of CBKinase1_003740
The XLogP value of 5.59392 indicates that CBKinase1_003740 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.29 Ų, CBKinase1_003740 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CBKinase1_003740 has 1 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_003740?
The CAS number of CBKinase1_003740 is 442865-43-2.
What is the molecular formula of CBKinase1_003740?
The molecular formula of CBKinase1_003740 is C20H14ClF3N4OS.
What is the molecular weight of CBKinase1_003740?
The molecular weight of CBKinase1_003740 is 450.05 g/mol.
Where can I buy CBKinase1_003740?
You can request a quote for CBKinase1_003740 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_003740?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_003740 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.