Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate
TL;DR: Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate (CAS 7232-35-1) is a chemical compound with molecular formula C20H20O4S and molecular weight 356.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate
Also Known As: Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate, Diethyl (10lambda~4~-thioxanthen-10(9H)-ylidene)propanedioate
| Molecular Formula | C20H20O4S |
|---|---|
| Molecular Weight | 356.11 g/mol |
| LogP | 3.5763 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.10822 |
| Heavy Atoms | 25 |
| Complexity | 786.7796 |
Chemical Identifiers
| CAS Number | 7232-35-1 |
|---|---|
| SMILES | CCOC(=O)C(=S1C2=CC=CC=C2CC3=CC=CC=C31)C(=O)OCC |
Product Overview
Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate (CAS 7232-35-1), with molecular formula C20H20O4S and molecular weight 356.11 g/mol. IUPAC: diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate.
Chemical Property Profile of Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate
Property Insights of Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate
The XLogP value of 3.5763 indicates that Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate has 0 hydrogen bond donor(s) and 4 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 Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate?
The CAS number of Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate is 7232-35-1.
What is the molecular formula of Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate?
The molecular formula of Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate is C20H20O4S.
What is the molecular weight of Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate?
The molecular weight of Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate is 356.11 g/mol.
Where can I buy Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate?
You can request a quote for Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2-(9H-thioxanthen-10-ylidene)propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.