Spiroxatrine
TL;DR: Spiroxatrine (CAS 1054-88-2) is a chemical compound with molecular formula C22H25N3O3 and molecular weight 379.1896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Also Known As: Spiroxatrine, Espiroxatrina, Spiroxatrinum, Spiroxatrine (R 5188), Spiroxatrine [INN]
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C22H25N3O3 |
| Molecular Weight | 379.1896 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.1896 Da |
| Heavy Atoms | 28 |
| Complexity | 557.0 |
| SMILES | C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC4COC5=CC=CC=C5O4 |
| InChIKey | JVGBTTIJPBFLTE-UHFFFAOYSA-N |
Product Description
Applications: Spiroxatrine 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).
Spiroxatrine (CAS 1054-88-2) is a pharmaceutical intermediate with the molecular formula C22H25N3O3 and a molecular weight of 379.19 g/mol. Synonyms include Spiroxatrine and Espiroxatrina.
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 Spiroxatrine
Property Insights of Spiroxatrine
The XLogP value of 3.1 indicates that Spiroxatrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, Spiroxatrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiroxatrine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Spiroxatrine?
The CAS number of Spiroxatrine is 1054-88-2.
What is the molecular formula of Spiroxatrine?
The molecular formula of Spiroxatrine is C22H25N3O3.
What is the molecular weight of Spiroxatrine?
The molecular weight of Spiroxatrine is 379.1896 g/mol.
What are the applications of Spiroxatrine?
Spiroxatrine 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 Spiroxatrine?
You can request a quote for Spiroxatrine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Spiroxatrine?
Yes, CoreyChem provides custom synthesis services for Spiroxatrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.