N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide
TL;DR: N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide (CAS 100001-06-7) is a chemical compound with molecular formula C20H28INO and molecular weight 425.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-(3-hydroxy-3,3-diphenylpropyl)-methylazanium iodide
Also Known As: 3,3-Diphenylpropan-3-ol diethylamine methiodide, Diethyl(3,3-diphenyl-3-hydroxypropyl)methylammonium iodide, Methyldiethyl-(3,3-diphenyl-3-hydroxypropyl) ammonium iodide, AMMONIUM, DIETHYL(3,3-DIPHENYL-3-HYDROXYPROPYL)METHYL-, IODIDE, diethyl-(3-hydroxy-3,3-diphenylpropyl)-methylazanium iodide
| Molecular Formula | C20H28INO |
|---|---|
| Molecular Weight | 425.12 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 425.12155 |
| Heavy Atoms | 23 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 100001-06-7 |
|---|---|
| SMILES | CC[N+](C)(CC)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)O.[I-] |
| InChIKey | HAMINVZRIHBDBO-UHFFFAOYSA-M |
Product Overview
N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide (CAS 100001-06-7), with molecular formula C20H28INO and molecular weight 425.12 g/mol. IUPAC: diethyl-(3-hydroxy-3,3-diphenylpropyl)-methylazanium iodide.
Chemical Property Profile of N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide
Property Insights of N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide. With a topological polar surface area (TPSA) of 20.2 Ų, N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide has 1 hydrogen bond donor(s) and 2 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 N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide?
The CAS number of N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide is 100001-06-7.
What is the molecular formula of N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide?
The molecular formula of N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide is C20H28INO.
What is the molecular weight of N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide?
The molecular weight of N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide is 425.12 g/mol.
Where can I buy N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide?
You can request a quote for N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethyl-3-hydroxy-N-methyl-3,3-diphenylpropan-1-aminium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.