CBKinase1_011704
TL;DR: CBKinase1_011704 (CAS 725692-34-2) is a chemical compound with molecular formula C27H25BrN2O5 and molecular weight 536.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]benzamide
Also Known As: CBKinase1_011704, CBKinase1_024104, BRD-K73701570-001-01-8, 3-bromo-N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]benzamide, 3-bromo-N-(2-((6,7-dimethoxyisoquinolin-1-yl)methyl)-4,5-dimethoxyphenyl)benzamide
| Molecular Formula | C27H25BrN2O5 |
|---|---|
| Molecular Weight | 536.09 g/mol |
| LogP | 5.8748 |
| Topological Polar Surface Area | 78.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 536.09467 |
| Heavy Atoms | 35 |
| Complexity | 1389.8654 |
Chemical Identifiers
| CAS Number | 725692-34-2 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C=CN=C2CC3=CC(=C(C=C3NC(=O)C4=CC(=CC=C4)Br)OC)OC)OC |
Product Overview
CBKinase1_011704 (CAS 725692-34-2), with molecular formula C27H25BrN2O5 and molecular weight 536.09 g/mol. IUPAC: 3-bromo-N-[2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl]benzamide.
Chemical Property Profile of CBKinase1_011704
Property Insights of CBKinase1_011704
The XLogP value of 5.8748 indicates that CBKinase1_011704 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.91 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_011704. Following Lipinski's Rule of Five, CBKinase1_011704 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CBKinase1_011704?
The CAS number of CBKinase1_011704 is 725692-34-2.
What is the molecular formula of CBKinase1_011704?
The molecular formula of CBKinase1_011704 is C27H25BrN2O5.
What is the molecular weight of CBKinase1_011704?
The molecular weight of CBKinase1_011704 is 536.09 g/mol.
Where can I buy CBKinase1_011704?
You can request a quote for CBKinase1_011704 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_011704?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_011704 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.