Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate
TL;DR: Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate (CAS 64050-89-1) is a chemical compound with molecular formula C16H27IN2O2 and molecular weight 406.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl-dimethyl-[3-methyl-2-(methylcarbamoyloxy)-6-propan-2-ylphenyl]azanium iodide
Also Known As: Carbamic acid, methyl-, (5-dimethylethylammonio)carvacryl ester, iodide, Ammonium, (6-methylcarbamoyloxythymyl)dimethylethyl-, iodide, Carbamic acid, N-methyl-, 4-dimethylaminocarvacryl ester, ethiodide, AMMONIUM, (6-HYDROXYTHYMYL)DIMETHYLETHYL-, IODIDE, METHYLCARBAMATE, Carbamic acid,N-methyl-,4-dimethylaminocarvacryl ester,ethiodide
| Molecular Formula | C16H27IN2O2 |
|---|---|
| Molecular Weight | 406.11 g/mol |
| LogP | 0.43 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.11172 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 64050-89-1 |
|---|---|
| SMILES | CC[N+](C)(C)C1=C(C=CC(=C1OC(=O)NC)C)C(C)C.[I-] |
| InChIKey | WGXDPDQWTOUCJV-UHFFFAOYSA-N |
Product Overview
Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate (CAS 64050-89-1), with molecular formula C16H27IN2O2 and molecular weight 406.11 g/mol. IUPAC: ethyl-dimethyl-[3-methyl-2-(methylcarbamoyloxy)-6-propan-2-ylphenyl]azanium iodide.
Chemical Property Profile of Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate
Property Insights of Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate
The XLogP value of 0.43 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate has 1 hydrogen bond donor(s) and 3 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, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate?
The CAS number of Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate is 64050-89-1.
What is the molecular formula of Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate?
The molecular formula of Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate is C16H27IN2O2.
What is the molecular weight of Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate?
The molecular weight of Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate is 406.11 g/mol.
Where can I buy Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate?
You can request a quote for Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (6-hydroxythymyl)dimethylethyl-, iodide, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.