Etomidoline
TL;DR: Etomidoline (CAS 21590-92-1) is a chemical compound with molecular formula C23H29N3O2 and molecular weight 379.22598 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethyl-3-[4-(2-piperidin-1-ylethoxy)anilino]-3H-isoindol-1-one
Also Known As: etomidoline, Amidoline, Smedolin, Nonspa, Etomidolina
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C23H29N3O2 |
| Molecular Weight | 379.22598 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.22598 Da |
| Heavy Atoms | 28 |
| Complexity | 500.0 |
| SMILES | CCN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)OCCN4CCCCC4 |
| InChIKey | ITIONVBQFUNVJV-UHFFFAOYSA-N |
Product Description
Applications: Etomidoline 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).
Etomidoline (CAS 21590-92-1) is a pharmaceutical intermediate with the molecular formula C23H29N3O2 and a molecular weight of 379.23 g/mol. Synonyms include etomidoline and Amidoline.
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 Etomidoline
Property Insights of Etomidoline
The XLogP value of 4.0 indicates that Etomidoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Etomidoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Etomidoline has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Etomidoline?
The CAS number of Etomidoline is 21590-92-1.
What is the molecular formula of Etomidoline?
The molecular formula of Etomidoline is C23H29N3O2.
What is the molecular weight of Etomidoline?
The molecular weight of Etomidoline is 379.22598 g/mol.
What are the applications of Etomidoline?
Etomidoline 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 Etomidoline?
You can request a quote for Etomidoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Etomidoline?
Yes, CoreyChem provides custom synthesis services for Etomidoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.