CBKinase1_008417
TL;DR: CBKinase1_008417 (CAS 371126-85-1) is a chemical compound with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide
Also Known As: CBKinase1_008417, CBKinase1_020817, BAS 07417988, AM-807/12427209, BRD-K95533235-001-01-6
| Molecular Formula | C17H17N3O4S |
|---|---|
| Molecular Weight | 359.09 g/mol |
| LogP | 2.303 |
| Topological Polar Surface Area | 104.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 359.09396 |
| Heavy Atoms | 25 |
| Complexity | 886.4373 |
Chemical Identifiers
| CAS Number | 371126-85-1 |
|---|---|
| SMILES | CC1=CC(=O)NC(=C1C#N)SCC(=O)NC2=CC(=C(C=C2)OC)OC |
Product Overview
CBKinase1_008417 (CAS 371126-85-1), with molecular formula C17H17N3O4S and molecular weight 359.09 g/mol. IUPAC: 2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide.
Chemical Property Profile of CBKinase1_008417
Property Insights of CBKinase1_008417
The XLogP value of 2.303 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_008417. The TPSA of 104.21 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_008417. Following Lipinski's Rule of Five, CBKinase1_008417 has 2 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_008417?
The CAS number of CBKinase1_008417 is 371126-85-1.
What is the molecular formula of CBKinase1_008417?
The molecular formula of CBKinase1_008417 is C17H17N3O4S.
What is the molecular weight of CBKinase1_008417?
The molecular weight of CBKinase1_008417 is 359.09 g/mol.
Where can I buy CBKinase1_008417?
You can request a quote for CBKinase1_008417 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_008417?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_008417 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.