Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate
TL;DR: Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate (CAS 64050-91-5) is a chemical compound with molecular formula C18H29IN2O3 and molecular weight 448.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[3-methyl-2-(morpholine-4-carbonyloxy)-6-propan-2-ylphenyl]azanium iodide
Also Known As: 4-Morpholinecarboxylic acid, 5-(trimethylammonio)carvacryl ester, iodide, Ammonium, (6-(morpholinocarbonyloxy)thymyl)trimethyl ester, iodide, AMMONIUM, (6-HYDROXYTHYMYL)TRIMETHYL-, IODIDE, 4-MORPHOLIN CARBOXYLATE, Carbamic acid, N,N-diethyleneoxy-, 4-dimethylaminocarvacryl ester, methiodide, N,N,N,3-Tetramethyl-2-[(morpholine-4-carbonyl)oxy]-6-(propan-2-yl)anilinium iodide
| Molecular Formula | C18H29IN2O3 |
|---|---|
| Molecular Weight | 448.12 g/mol |
| LogP | 0.15 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 448.12228 |
| Heavy Atoms | 24 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 64050-91-5 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C(C)C)[N+](C)(C)C)OC(=O)N2CCOCC2.[I-] |
| InChIKey | RBXGHPSVPLTYTG-UHFFFAOYSA-M |
Product Overview
Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate (CAS 64050-91-5), with molecular formula C18H29IN2O3 and molecular weight 448.12 g/mol. IUPAC: trimethyl-[3-methyl-2-(morpholine-4-carbonyloxy)-6-propan-2-ylphenyl]azanium iodide.
Chemical Property Profile of Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate
Property Insights of Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate
The XLogP value of 0.15 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate. With a topological polar surface area (TPSA) of 38.8 Ų, Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate 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, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate?
The CAS number of Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate is 64050-91-5.
What is the molecular formula of Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate?
The molecular formula of Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate is C18H29IN2O3.
What is the molecular weight of Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate?
The molecular weight of Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate is 448.12 g/mol.
Where can I buy Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate?
You can request a quote for Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate 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)trimethyl-, iodide, 4-morpholin carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (6-hydroxythymyl)trimethyl-, iodide, 4-morpholin carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.