CBKinase1_004198
TL;DR: CBKinase1_004198 (CAS 500113-86-0) is a chemical compound with molecular formula C15H20N4O2S and molecular weight 320.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-amino-5,6-dimethylfuro[2,3-d]pyrimidin-2-yl)sulfanyl-1-piperidin-1-ylethanone
Also Known As: CBKinase1_004198, CBKinase1_016598, IFLab1_005911, IDI1_011314, 2-((4-amino-5,6-dimethylfuro[2,3-d]pyrimidin-2-yl)thio)-1-(piperidin-1-yl)ethanone
| Molecular Formula | C15H20N4O2S |
|---|---|
| Molecular Weight | 320.13 g/mol |
| LogP | 2.52644 |
| Topological Polar Surface Area | 85.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.1307 |
| Heavy Atoms | 22 |
| Complexity | 707.1206 |
Chemical Identifiers
| CAS Number | 500113-86-0 |
|---|---|
| SMILES | CC1=C(OC2=NC(=NC(=C12)N)SCC(=O)N3CCCCC3)C |
Product Overview
CBKinase1_004198 (CAS 500113-86-0), with molecular formula C15H20N4O2S and molecular weight 320.13 g/mol. IUPAC: 2-(4-amino-5,6-dimethylfuro[2,3-d]pyrimidin-2-yl)sulfanyl-1-piperidin-1-ylethanone.
Chemical Property Profile of CBKinase1_004198
Property Insights of CBKinase1_004198
The XLogP value of 2.52644 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CBKinase1_004198. The TPSA of 85.25 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004198. Following Lipinski's Rule of Five, CBKinase1_004198 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_004198?
The CAS number of CBKinase1_004198 is 500113-86-0.
What is the molecular formula of CBKinase1_004198?
The molecular formula of CBKinase1_004198 is C15H20N4O2S.
What is the molecular weight of CBKinase1_004198?
The molecular weight of CBKinase1_004198 is 320.13 g/mol.
Where can I buy CBKinase1_004198?
You can request a quote for CBKinase1_004198 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_004198?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_004198 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.