二异丙基磷酰硫代胆碱碘化物
TL;DR: 二异丙基磷酰硫代胆碱碘化物 (CAS 2641-06-7) is a chemical compound with molecular formula C11H27INO3PS and molecular weight 411.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二异丙基磷酰硫代胆碱碘化物
2-di(propan-2-yloxy)phosphorylsulfanylethyl-trimethylazanium iodide
Also Known As: Diisopropylphosphorylthiocholine iodide, Diisopropoxyphosphorylthiocholine iodide, 2-di(propan-2-yloxy)phosphorylsulfanylethyl-trimethylazanium iodide, O,O-Diisopropyl S-(2-dimethylamino)ethylphosphorothiolate methiodide, 2-di(propan-2-yloxy)phosphorylsulfanylethyl-trimethylazanium;iodide
| Molecular Formula | C11H27INO3PS |
|---|---|
| Molecular Weight | 411.05 g/mol |
| LogP | 0.39 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 411.0494 |
| Heavy Atoms | 18 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 2641-06-7 |
|---|---|
| SMILES | CC(C)OP(=O)(OC(C)C)SCC[N+](C)(C)C.[I-] |
| InChIKey | HBZREFMVMBMARG-UHFFFAOYSA-M |
Product Overview
二异丙基磷酰硫代胆碱碘化物 (CAS 2641-06-7), with molecular formula C11H27INO3PS and molecular weight 411.05 g/mol. IUPAC: 2-di(propan-2-yloxy)phosphorylsulfanylethyl-trimethylazanium iodide.
Chemical Property Profile of 二异丙基磷酰硫代胆碱碘化物
Property Insights of 二异丙基磷酰硫代胆碱碘化物
The XLogP value of 0.39 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二异丙基磷酰硫代胆碱碘化物. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 二异丙基磷酰硫代胆碱碘化物. Following Lipinski's Rule of Five, 二异丙基磷酰硫代胆碱碘化物 has 0 hydrogen bond donor(s) and 5 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 二异丙基磷酰硫代胆碱碘化物?
The CAS number of 二异丙基磷酰硫代胆碱碘化物 is 2641-06-7.
What is the molecular formula of 二异丙基磷酰硫代胆碱碘化物?
The molecular formula of 二异丙基磷酰硫代胆碱碘化物 is C11H27INO3PS.
What is the molecular weight of 二异丙基磷酰硫代胆碱碘化物?
The molecular weight of 二异丙基磷酰硫代胆碱碘化物 is 411.05 g/mol.
Where can I buy 二异丙基磷酰硫代胆碱碘化物?
You can request a quote for 二异丙基磷酰硫代胆碱碘化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二异丙基磷酰硫代胆碱碘化物?
Yes, KEHONG BIO provides custom synthesis services for 二异丙基磷酰硫代胆碱碘化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.