F0579-0671
TL;DR: F0579-0671 (CAS 687564-80-3) is a chemical compound with molecular formula C21H19ClN2OS2 and molecular weight 414.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
Also Known As: F0579-0671, 3-(4-chlorophenyl)-2-((2,5-dimethylbenzyl)thio)-6,7-dihydrothieno[3,2-d]pyrimidin-4(3H)-one, 3-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-4-one, 3-(4-chlorophenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one
| Molecular Formula | C21H19ClN2OS2 |
|---|---|
| Molecular Weight | 414.06 g/mol |
| LogP | 5.44324 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.06274 |
| Heavy Atoms | 27 |
| Complexity | 1061.0121 |
Chemical Identifiers
| CAS Number | 687564-80-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)Cl)SCC3 |
Product Overview
F0579-0671 (CAS 687564-80-3), with molecular formula C21H19ClN2OS2 and molecular weight 414.06 g/mol. IUPAC: 3-(4-chlorophenyl)-2-[(2,5-dimethylphenyl)methylsulfanyl]-6,7-dihydrothieno[3,2-d]pyrimidin-4-one.
Chemical Property Profile of F0579-0671
Property Insights of F0579-0671
The XLogP value of 5.44324 indicates that F0579-0671 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, F0579-0671 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0579-0671 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0579-0671?
The CAS number of F0579-0671 is 687564-80-3.
What is the molecular formula of F0579-0671?
The molecular formula of F0579-0671 is C21H19ClN2OS2.
What is the molecular weight of F0579-0671?
The molecular weight of F0579-0671 is 414.06 g/mol.
Where can I buy F0579-0671?
You can request a quote for F0579-0671 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0579-0671?
Yes, KEHONG BIO provides custom synthesis services for F0579-0671 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.