Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate
TL;DR: Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate (CAS 64050-79-9) is a chemical compound with molecular formula C18H24N2O6S and molecular weight 396.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl sulfate;trimethyl-[3-[methyl(phenyl)carbamoyl]oxyphenyl]azanium
Also Known As: AMMONIUM, (m-HYDROXYPHENYL)TRIMETHYL-, METHYLSULFATE, METHYLPHENYLCARBAMATE, Methylphenylcarbamic ester of 3-oxyphenyltrimethylammonium methylsulfate, Carbamic acid, N-methyl-N-phenyl-, 3-(trimethylammonio)phenyl ester, Ammonium, (3-(N'-methyl-N'-phenylcarbamoyloxy)phenyl)trimethyl-, methylsulfate, methyl sulfate; trimethyl-[3-[methyl(phenyl)carbamoyl]oxyphenyl]azanium
| Molecular Formula | C18H24N2O6S |
|---|---|
| Molecular Weight | 396.14 g/mol |
| LogP | 2.61 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 396.1355 |
| Heavy Atoms | 27 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 64050-79-9 |
|---|---|
| SMILES | CN(C1=CC=CC=C1)C(=O)OC2=CC=CC(=C2)[N+](C)(C)C.COS(=O)(=O)[O-] |
| InChIKey | NZONVSABIFGBSY-UHFFFAOYSA-M |
Product Overview
Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate (CAS 64050-79-9), with molecular formula C18H24N2O6S and molecular weight 396.14 g/mol. IUPAC: methyl sulfate;trimethyl-[3-[methyl(phenyl)carbamoyl]oxyphenyl]azanium.
Chemical Property Profile of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate
Property Insights of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate
The XLogP value of 2.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate. Following Lipinski's Rule of Five, Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate has 0 hydrogen bond donor(s) and 6 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, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate?
The CAS number of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate is 64050-79-9.
What is the molecular formula of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate?
The molecular formula of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate is C18H24N2O6S.
What is the molecular weight of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate?
The molecular weight of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate is 396.14 g/mol.
Where can I buy Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate?
You can request a quote for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, methylphenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.