Methaphenilene
TL;DR: Methaphenilene (CAS 493-78-7) is a chemical compound with molecular formula C15H20N2S and molecular weight 260.1347 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-N'-phenyl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine
Also Known As: Methaphenilene, Diatrin, Metafenileno, Diatrin Base, Methaphenilenum
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H20N2S |
| Molecular Weight | 260.1347 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 34.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 260.1347 Da |
| Heavy Atoms | 18 |
| Complexity | 227.0 |
| SMILES | CN(C)CCN(CC1=CC=CS1)C2=CC=CC=C2 |
| InChIKey | LDYJXVUOVPVZKA-UHFFFAOYSA-N |
Product Description
Applications: Methaphenilene is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Methaphenilene (CAS 493-78-7) is a pharmaceutical intermediate with the molecular formula C15H20N2S and a molecular weight of 260.13 g/mol. Synonyms include Methaphenilene and Diatrin.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Methaphenilene
Property Insights of Methaphenilene
The XLogP value of 3.3 indicates that Methaphenilene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.7 Ų, Methaphenilene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methaphenilene 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
What is the CAS number of Methaphenilene?
The CAS number of Methaphenilene is 493-78-7.
What is the molecular formula of Methaphenilene?
The molecular formula of Methaphenilene is C15H20N2S.
What is the molecular weight of Methaphenilene?
The molecular weight of Methaphenilene is 260.1347 g/mol.
What are the applications of Methaphenilene?
Methaphenilene is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Methaphenilene?
You can request a quote for Methaphenilene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methaphenilene?
Yes, CoreyChem provides custom synthesis services for Methaphenilene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.