Captodiame
TL;DR: Captodiame (CAS 486-17-9) is a chemical compound with molecular formula C21H29NS2 and molecular weight 359.17413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(4-butylsulfanylphenyl)-phenylmethyl]sulfanyl-N,N-dimethylethanamine
Also Known As: Captodiame, Captodiamine, Captodiamin, Captodramin, Captodramine
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H29NS2 |
| Molecular Weight | 359.17413 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 53.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 359.17413 Da |
| Heavy Atoms | 24 |
| Complexity | 307.0 |
| Melting Point | 124 |
| SMILES | CCCCSC1=CC=C(C=C1)C(C2=CC=CC=C2)SCCN(C)C |
| InChIKey | IZLPZXSZLLELBJ-UHFFFAOYSA-N |
Product Description
Applications: Captodiame is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Captodiame (CAS 486-17-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Captodiame (CAS 486-17-9) has the molecular formula C21H29NS2 and a molecular weight of 359.17 g/mol. It is also known as Captodiame and Captodiamine.
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 Captodiame
Property Insights of Captodiame
The XLogP value of 5.9 indicates that Captodiame is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.8 Ų, Captodiame exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Captodiame has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Captodiame?
The CAS number of Captodiame is 486-17-9.
What is the molecular formula of Captodiame?
The molecular formula of Captodiame is C21H29NS2.
What is the molecular weight of Captodiame?
The molecular weight of Captodiame is 359.17413 g/mol.
What are the applications of Captodiame?
Captodiame is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Captodiame (CAS 486-17-9) with custom synthesis available from...
Where can I buy Captodiame?
You can request a quote for Captodiame directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Captodiame?
Yes, CoreyChem provides custom synthesis services for Captodiame and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.