AS-871/41500902
TL;DR: AS-871/41500902 (CAS 538338-34-0) is a chemical compound with molecular formula C17H14Cl2N2O3S and molecular weight 396.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-chlorophenyl)-1-(4-chlorophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one
Also Known As: AS-871/41500902, 1-(3-chlorophenyl)-3-(4-chlorophenyl)tetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one 5,5-dioxide, 3-(3-chlorophenyl)-1-(4-chlorophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one, 4-(4-chlorophenyl)-6-(3-chlorophenyl)-1,3,4,6,3a,6a-hexahydro-2-thia-4,6-diaza pentalene-2,2,5-trione
| Molecular Formula | C17H14Cl2N2O3S |
|---|---|
| Molecular Weight | 396.01 g/mol |
| LogP | 3.6056 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 396.01022 |
| Heavy Atoms | 25 |
| Complexity | 946.62024 |
Chemical Identifiers
| CAS Number | 538338-34-0 |
|---|---|
| SMILES | C1C2C(CS1(=O)=O)N(C(=O)N2C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)Cl |
Product Overview
AS-871/41500902 (CAS 538338-34-0), with molecular formula C17H14Cl2N2O3S and molecular weight 396.01 g/mol. IUPAC: 3-(3-chlorophenyl)-1-(4-chlorophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]imidazol-2-one.
Chemical Property Profile of AS-871/41500902
Property Insights of AS-871/41500902
The XLogP value of 3.6056 indicates that AS-871/41500902 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, AS-871/41500902 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AS-871/41500902 has 0 hydrogen bond donor(s) and 3 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 AS-871/41500902?
The CAS number of AS-871/41500902 is 538338-34-0.
What is the molecular formula of AS-871/41500902?
The molecular formula of AS-871/41500902 is C17H14Cl2N2O3S.
What is the molecular weight of AS-871/41500902?
The molecular weight of AS-871/41500902 is 396.01 g/mol.
Where can I buy AS-871/41500902?
You can request a quote for AS-871/41500902 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AS-871/41500902?
Yes, KEHONG BIO provides custom synthesis services for AS-871/41500902 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.