Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate
TL;DR: Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate (CAS 64046-10-2) is a chemical compound with molecular formula C15H25IN2O2 and molecular weight 392.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[4-[3-(methylcarbamoyloxy)phenyl]butan-2-yl]azanium iodide
Also Known As: T-2039, Carbamic acid, methyl-, 3-(3-(trimethylammonio)butyl)phenyl ester, iodide, Ammonium, (4-(3-(methylcarbamoyloxy)phenyl)-sec-butyl)trimethyl-, iodide, Carbamic acid, N-methyl-, 3-(3-dimethylamino-n-butyl)-phenyl ester, methiodide, AMMONIUM, (4-(3-HYDROXYPHENYL)-sec-BUTYL)TRIMETHYL-, IODIDE, METHYLCARBAMATE
| Molecular Formula | C15H25IN2O2 |
|---|---|
| Molecular Weight | 392.10 g/mol |
| LogP | -0.56 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.09607 |
| Heavy Atoms | 20 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 64046-10-2 |
|---|---|
| SMILES | CC(CCC1=CC(=CC=C1)OC(=O)NC)[N+](C)(C)C.[I-] |
| InChIKey | SSGJYGLHCFJDEP-UHFFFAOYSA-N |
Product Overview
Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate (CAS 64046-10-2), with molecular formula C15H25IN2O2 and molecular weight 392.10 g/mol. IUPAC: trimethyl-[4-[3-(methylcarbamoyloxy)phenyl]butan-2-yl]azanium iodide.
Chemical Property Profile of Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate
Property Insights of Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate
The XLogP value of -0.56 indicates that Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, 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, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate?
The CAS number of Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate is 64046-10-2.
What is the molecular formula of Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate?
The molecular formula of Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate is C15H25IN2O2.
What is the molecular weight of Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate?
The molecular weight of Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate is 392.10 g/mol.
Where can I buy Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate?
You can request a quote for Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, 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, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (4-(3-hydroxyphenyl)-sec-butyl)trimethyl-, iodide, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.