依米碘铵
TL;DR: 依米碘铵 (CAS 5982-52-5) is a chemical compound with molecular formula C20H28INO and molecular weight 425.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
依米碘铵
2-benzhydryloxyethyl-diethyl-methylazanium iodide
Also Known As: Metropin, emetonium iodide, Esyntin, Metropin (R), Ethylbenzhydramine methyl iodide
| Molecular Formula | C20H28INO |
|---|---|
| Molecular Weight | 425.12 g/mol |
| LogP | 1.28 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 425.12155 |
| Heavy Atoms | 23 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 5982-52-5 |
|---|---|
| SMILES | CC[N+](C)(CC)CCOC(C1=CC=CC=C1)C2=CC=CC=C2.[I-] |
| InChIKey | HKOZYKMXXBHEHT-UHFFFAOYSA-M |
Product Overview
依米碘铵 (CAS 5982-52-5), with molecular formula C20H28INO and molecular weight 425.12 g/mol. IUPAC: 2-benzhydryloxyethyl-diethyl-methylazanium iodide.
Chemical Property Profile of 依米碘铵
Property Insights of 依米碘铵
The XLogP value of 1.28 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 依米碘铵. With a topological polar surface area (TPSA) of 9.2 Ų, 依米碘铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 依米碘铵 has 0 hydrogen bond donor(s) and 2 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 依米碘铵?
The CAS number of 依米碘铵 is 5982-52-5.
What is the molecular formula of 依米碘铵?
The molecular formula of 依米碘铵 is C20H28INO.
What is the molecular weight of 依米碘铵?
The molecular weight of 依米碘铵 is 425.12 g/mol.
Where can I buy 依米碘铵?
You can request a quote for 依米碘铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 依米碘铵?
Yes, KEHONG BIO provides custom synthesis services for 依米碘铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.