2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione
TL;DR: 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione (CAS 69241-95-8) is a chemical compound with molecular formula C27H22O4S and molecular weight 442.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione
Also Known As: 2,3-dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione, 2,4-dione, 2,3-dimethoxy-5-[(triphenylmethyl)thio]-, 2,3-Dimethoxy-5-[(triphenylmethyl)sulfanyl]cyclohexa-2,5-diene-1,4-dione
| Molecular Formula | C27H22O4S |
|---|---|
| Molecular Weight | 442.12 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 77.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.12387 |
| Heavy Atoms | 32 |
| Complexity | 704.0 |
Chemical Identifiers
| CAS Number | 69241-95-8 |
|---|---|
| SMILES | COC1=C(C(=O)C(=CC1=O)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC |
| InChIKey | FSRXUURUQDPCRZ-UHFFFAOYSA-N |
Product Overview
2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione (CAS 69241-95-8), with molecular formula C27H22O4S and molecular weight 442.12 g/mol. IUPAC: 2,3-dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione.
Chemical Property Profile of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione
Property Insights of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione
The XLogP value of 5.8 indicates that 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione. Following Lipinski's Rule of Five, 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione?
The CAS number of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione is 69241-95-8.
What is the molecular formula of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione?
The molecular formula of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione is C27H22O4S.
What is the molecular weight of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione?
The molecular weight of 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione is 442.12 g/mol.
Where can I buy 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione?
You can request a quote for 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethoxy-5-tritylsulfanylcyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.