CBKinase1_004016
TL;DR: CBKinase1_004016 (CAS 890643-84-2) is a chemical compound with molecular formula C19H24N2O5 and molecular weight 360.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[3-(4-acetyl-3,5-dimethylpyrazol-1-yl)-2-hydroxypropoxy]-3-methoxyphenyl]ethanone
Also Known As: CBKinase1_004016, CBKinase1_016416, BAS 06496853, AP-124/41972166, BRD-A68939439-001-01-4
| Molecular Formula | C19H24N2O5 |
|---|---|
| Molecular Weight | 360.17 g/mol |
| LogP | 2.35364 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 360.16852 |
| Heavy Atoms | 26 |
| Complexity | 825.5772 |
Chemical Identifiers
| CAS Number | 890643-84-2 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(COC2=C(C=C(C=C2)C(=O)C)OC)O)C)C(=O)C |
Product Overview
CBKinase1_004016 (CAS 890643-84-2), with molecular formula C19H24N2O5 and molecular weight 360.17 g/mol. IUPAC: 1-[4-[3-(4-acetyl-3,5-dimethylpyrazol-1-yl)-2-hydroxypropoxy]-3-methoxyphenyl]ethanone.
Chemical Property Profile of CBKinase1_004016
Property Insights of CBKinase1_004016
The XLogP value of 2.35364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_004016. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004016. Following Lipinski's Rule of Five, CBKinase1_004016 has 1 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_004016?
The CAS number of CBKinase1_004016 is 890643-84-2.
What is the molecular formula of CBKinase1_004016?
The molecular formula of CBKinase1_004016 is C19H24N2O5.
What is the molecular weight of CBKinase1_004016?
The molecular weight of CBKinase1_004016 is 360.17 g/mol.
Where can I buy CBKinase1_004016?
You can request a quote for CBKinase1_004016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004016?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.