CBKinase1_004189
TL;DR: CBKinase1_004189 (CAS 695200-58-9) is a chemical compound with molecular formula C24H17ClF3N3O2 and molecular weight 471.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
Also Known As: CBKinase1_004189, CBKinase1_016589, A3322/0141111, BRD-K95455749-001-01-1, 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
| Molecular Formula | C24H17ClF3N3O2 |
|---|---|
| Molecular Weight | 471.10 g/mol |
| LogP | 5.7645 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 471.09613 |
| Heavy Atoms | 33 |
| Complexity | 1382.6016 |
Chemical Identifiers
| CAS Number | 695200-58-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN(C2=O)CCC(=O)NC3=CC=CC(=C3)C(F)(F)F)C4=CC=C(C=C4)Cl |
Product Overview
CBKinase1_004189 (CAS 695200-58-9), with molecular formula C24H17ClF3N3O2 and molecular weight 471.10 g/mol. IUPAC: 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-[3-(trifluoromethyl)phenyl]propanamide.
Chemical Property Profile of CBKinase1_004189
Property Insights of CBKinase1_004189
The XLogP value of 5.7645 indicates that CBKinase1_004189 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004189. Following Lipinski's Rule of Five, CBKinase1_004189 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_004189?
The CAS number of CBKinase1_004189 is 695200-58-9.
What is the molecular formula of CBKinase1_004189?
The molecular formula of CBKinase1_004189 is C24H17ClF3N3O2.
What is the molecular weight of CBKinase1_004189?
The molecular weight of CBKinase1_004189 is 471.10 g/mol.
Where can I buy CBKinase1_004189?
You can request a quote for CBKinase1_004189 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004189?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004189 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.