乙咪多林
TL;DR: 乙咪多林 (CAS 21590-92-1) is a chemical compound with molecular formula C23H29N3O2 and molecular weight 379.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙咪多林
2-ethyl-3-[4-(2-piperidin-1-ylethoxy)anilino]-3H-isoindol-1-one
Also Known As: etomidoline, Amidoline, Smedolin, Nonspa, Etomidolina
| Molecular Formula | C23H29N3O2 |
|---|---|
| Molecular Weight | 379.23 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 379.22598 |
| Heavy Atoms | 28 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 21590-92-1 |
|---|---|
| SMILES | CCN1C(C2=CC=CC=C2C1=O)NC3=CC=C(C=C3)OCCN4CCCCC4 |
| InChIKey | ITIONVBQFUNVJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙咪多林 (CAS 21590-92-1), with molecular formula C23H29N3O2 and molecular weight 379.23 g/mol. IUPAC: 2-ethyl-3-[4-(2-piperidin-1-ylethoxy)anilino]-3H-isoindol-1-one.
Chemical Property Profile of 乙咪多林
Property Insights of 乙咪多林
The XLogP value of 4.0 indicates that 乙咪多林 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 乙咪多林 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙咪多林 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
Frequently Asked Questions
What is the CAS number of 乙咪多林?
The CAS number of 乙咪多林 is 21590-92-1.
What is the molecular formula of 乙咪多林?
The molecular formula of 乙咪多林 is C23H29N3O2.
What is the molecular weight of 乙咪多林?
The molecular weight of 乙咪多林 is 379.23 g/mol.
Where can I buy 乙咪多林?
You can request a quote for 乙咪多林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙咪多林?
Yes, KEHONG BIO provides custom synthesis services for 乙咪多林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.