CBKinase1_006333
TL;DR: CBKinase1_006333 (CAS 579446-18-7) is a chemical compound with molecular formula C22H25N5O3S and molecular weight 439.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2-methoxy-N-methyl-5-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
Also Known As: CBKinase1_006333, CBKinase1_018733, BRD-K69495176-001-01-1, N-butyl-2-methoxy-N-methyl-5-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide, N-butyl-2-methoxy-N-methyl-5-(6-methyl[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide
| Molecular Formula | C22H25N5O3S |
|---|---|
| Molecular Weight | 439.17 g/mol |
| LogP | 3.68212 |
| Topological Polar Surface Area | 89.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 439.16782 |
| Heavy Atoms | 31 |
| Complexity | 1364.5972 |
Chemical Identifiers
| CAS Number | 579446-18-7 |
|---|---|
| SMILES | CCCCN(C)S(=O)(=O)C1=C(C=CC(=C1)C2=NN=C3N2N=C(C4=CC=CC=C43)C)OC |
Product Overview
CBKinase1_006333 (CAS 579446-18-7), with molecular formula C22H25N5O3S and molecular weight 439.17 g/mol. IUPAC: N-butyl-2-methoxy-N-methyl-5-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)benzenesulfonamide.
Chemical Property Profile of CBKinase1_006333
Property Insights of CBKinase1_006333
The XLogP value of 3.68212 indicates that CBKinase1_006333 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.69 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006333. Following Lipinski's Rule of Five, CBKinase1_006333 has 0 hydrogen bond donor(s) and 6 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_006333?
The CAS number of CBKinase1_006333 is 579446-18-7.
What is the molecular formula of CBKinase1_006333?
The molecular formula of CBKinase1_006333 is C22H25N5O3S.
What is the molecular weight of CBKinase1_006333?
The molecular weight of CBKinase1_006333 is 439.17 g/mol.
Where can I buy CBKinase1_006333?
You can request a quote for CBKinase1_006333 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006333?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006333 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.