Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate
TL;DR: Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate (CAS 64046-15-7) is a chemical compound with molecular formula C17H27IN2O2 and molecular weight 418.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-methyl-[3-(piperidine-1-carbonyloxy)phenyl]azanium iodide
Also Known As: 1-Piperidinecarboxylic acid, m-(diethylmethylammonio)phenyl ester, iodide, Ammonium, (3-(pentamethylenecarbamoyloxy)phenyl)diethylmethyl-, iodide, Carbamic acid, N,N-pentamethylene-, 3-diethylaminophenyl ester, methiodide, AMMONIUM, (m-HYDROXYPHENYL)DIETHYLMETHYL-, IODIDE, 1-PIPERIDINECARBOXYLATE, Carbamic acid, pentamethylene-, m-(diethylmethylammonio)phenyl ester, iodide
| Molecular Formula | C17H27IN2O2 |
|---|---|
| Molecular Weight | 418.11 g/mol |
| LogP | 0.65 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.11172 |
| Heavy Atoms | 22 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 64046-15-7 |
|---|---|
| SMILES | CC[N+](C)(CC)C1=CC(=CC=C1)OC(=O)N2CCCCC2.[I-] |
| InChIKey | NVRKSWBFVVXQJO-UHFFFAOYSA-M |
Product Overview
Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate (CAS 64046-15-7), with molecular formula C17H27IN2O2 and molecular weight 418.11 g/mol. IUPAC: diethyl-methyl-[3-(piperidine-1-carbonyloxy)phenyl]azanium iodide.
Chemical Property Profile of Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate
Property Insights of Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate
The XLogP value of 0.65 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate. With a topological polar surface area (TPSA) of 29.5 Ų, Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate has 0 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, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate?
The CAS number of Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate is 64046-15-7.
What is the molecular formula of Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate?
The molecular formula of Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate is C17H27IN2O2.
What is the molecular weight of Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate?
The molecular weight of Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate is 418.11 g/mol.
Where can I buy Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate?
You can request a quote for Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate 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)diethylmethyl-, iodide, 1-piperidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (m-hydroxyphenyl)diethylmethyl-, iodide, 1-piperidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.