F1453-0004
TL;DR: F1453-0004 (CAS 620589-87-9) is a chemical compound with molecular formula C20H22N2O4S2 and molecular weight 418.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-dimethoxyphenyl)-1-(4-methylphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazole-2-thione
Also Known As: F1453-0004, 1-(2,5-dimethoxyphenyl)-3-(4-methylphenyl)-2-sulfanylidene-hexahydro-1H-5lambda6-thieno[3,4-d]imidazole-5,5-dione, 1-(2,5-dimethoxyphenyl)-3-(p-tolyl)tetrahydro-1H-thieno[3,4-d]imidazole-2(3H)-thione 5,5-dioxide, 3-(2,5-dimethoxyphenyl)-1-(4-methylphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazole-2-thione
| Molecular Formula | C20H22N2O4S2 |
|---|---|
| Molecular Weight | 418.10 g/mol |
| LogP | 2.78932 |
| Topological Polar Surface Area | 59.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 418.1021 |
| Heavy Atoms | 28 |
| Complexity | 1021.0012 |
Chemical Identifiers
| CAS Number | 620589-87-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3CS(=O)(=O)CC3N(C2=S)C4=C(C=CC(=C4)OC)OC |
Product Overview
F1453-0004 (CAS 620589-87-9), with molecular formula C20H22N2O4S2 and molecular weight 418.10 g/mol. IUPAC: 3-(2,5-dimethoxyphenyl)-1-(4-methylphenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazole-2-thione.
Chemical Property Profile of F1453-0004
Property Insights of F1453-0004
The XLogP value of 2.78932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1453-0004. With a topological polar surface area (TPSA) of 59.08 Ų, F1453-0004 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1453-0004 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 F1453-0004?
The CAS number of F1453-0004 is 620589-87-9.
What is the molecular formula of F1453-0004?
The molecular formula of F1453-0004 is C20H22N2O4S2.
What is the molecular weight of F1453-0004?
The molecular weight of F1453-0004 is 418.10 g/mol.
Where can I buy F1453-0004?
You can request a quote for F1453-0004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1453-0004?
Yes, KEHONG BIO provides custom synthesis services for F1453-0004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.