IFLab1_002371
TL;DR: IFLab1_002371 (CAS 686770-10-5) is a chemical compound with molecular formula C21H25N3O2S2 and molecular weight 415.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
Also Known As: IFLab1_002371, F0579-0006, 2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one, 2-((2-(2-ethylpiperidin-1-yl)-2-oxoethyl)thio)-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one, 2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
| Molecular Formula | C21H25N3O2S2 |
|---|---|
| Molecular Weight | 415.14 g/mol |
| LogP | 3.7639 |
| Topological Polar Surface Area | 55.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 415.13882 |
| Heavy Atoms | 28 |
| Complexity | 913.857 |
Chemical Identifiers
| CAS Number | 686770-10-5 |
|---|---|
| SMILES | CCC1CCCCN1C(=O)CSC2=NC3=C(C(=O)N2C4=CC=CC=C4)SCC3 |
Product Overview
IFLab1_002371 (CAS 686770-10-5), with molecular formula C21H25N3O2S2 and molecular weight 415.14 g/mol. IUPAC: 2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one.
Chemical Property Profile of IFLab1_002371
Property Insights of IFLab1_002371
The XLogP value of 3.7639 indicates that IFLab1_002371 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.2 Ų, IFLab1_002371 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, IFLab1_002371 has 0 hydrogen bond donor(s) and 5 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 IFLab1_002371?
The CAS number of IFLab1_002371 is 686770-10-5.
What is the molecular formula of IFLab1_002371?
The molecular formula of IFLab1_002371 is C21H25N3O2S2.
What is the molecular weight of IFLab1_002371?
The molecular weight of IFLab1_002371 is 415.14 g/mol.
Where can I buy IFLab1_002371?
You can request a quote for IFLab1_002371 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_002371?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_002371 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.