Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate
TL;DR: Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate (CAS 37287-53-9) is a chemical compound with molecular formula C18H30INO3 and molecular weight 435.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]oxypropyl]azanium iodide
Also Known As: T 2435, Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate, n,n,n-trimethyl-2-({[5-methyl-2-(propan-2-yl)phenoxy]acetyl}oxy)propan-1-aminium iodide, trimethyl-[2-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]oxypropyl]azanium iodide
| Molecular Formula | C18H30INO3 |
|---|---|
| Molecular Weight | 435.13 g/mol |
| LogP | 0.13912 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 435.12704 |
| Heavy Atoms | 23 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 37287-53-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCC(=O)OC(C)C[N+](C)(C)C.[I-] |
| InChIKey | IHMMRSADAQVAIU-UHFFFAOYSA-M |
Product Overview
Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate (CAS 37287-53-9), with molecular formula C18H30INO3 and molecular weight 435.13 g/mol. IUPAC: trimethyl-[2-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]oxypropyl]azanium iodide.
Chemical Property Profile of Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate
Property Insights of Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate
The XLogP value of 0.13912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate. With a topological polar surface area (TPSA) of 35.5 Ų, Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate has 0 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 Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate?
The CAS number of Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate is 37287-53-9.
What is the molecular formula of Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate?
The molecular formula of Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate is C18H30INO3.
What is the molecular weight of Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate?
The molecular weight of Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate is 435.13 g/mol.
Where can I buy Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate?
You can request a quote for Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, 2-(hydroxypropyl)trimethyl-, iodide, (thymyloxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.