CBKinase1_006936
TL;DR: CBKinase1_006936 (CAS 701929-86-4) is a chemical compound with molecular formula C23H26N6O4S and molecular weight 482.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[4-methoxy-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]sulfonylpiperazin-1-yl]ethanol
Also Known As: CBKinase1_006936, CBKinase1_019336, BRD-K06918029-001-01-7, 2-[4-[4-methoxy-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]sulfonylpiperazin-1-yl]ethanol, 2-(4-((4-methoxy-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl)sulfonyl)piperazin-1-yl)ethanol
| Molecular Formula | C23H26N6O4S |
|---|---|
| Molecular Weight | 482.17 g/mol |
| LogP | 1.56012 |
| Topological Polar Surface Area | 113.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 482.1736 |
| Heavy Atoms | 34 |
| Complexity | 1461.3799 |
Chemical Identifiers
| CAS Number | 701929-86-4 |
|---|---|
| SMILES | CC1=NN2C(=NN=C2C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CCO)OC)C5=CC=CC=C15 |
Product Overview
CBKinase1_006936 (CAS 701929-86-4), with molecular formula C23H26N6O4S and molecular weight 482.17 g/mol. IUPAC: 2-[4-[4-methoxy-3-(6-methyl-[1,2,4]triazolo[3,4-a]phthalazin-3-yl)phenyl]sulfonylpiperazin-1-yl]ethanol.
Chemical Property Profile of CBKinase1_006936
Property Insights of CBKinase1_006936
The XLogP value of 1.56012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_006936. The TPSA of 113.16 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006936. Following Lipinski's Rule of Five, CBKinase1_006936 has 1 hydrogen bond donor(s) and 8 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_006936?
The CAS number of CBKinase1_006936 is 701929-86-4.
What is the molecular formula of CBKinase1_006936?
The molecular formula of CBKinase1_006936 is C23H26N6O4S.
What is the molecular weight of CBKinase1_006936?
The molecular weight of CBKinase1_006936 is 482.17 g/mol.
Where can I buy CBKinase1_006936?
You can request a quote for CBKinase1_006936 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_006936?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_006936 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.