1,2-Hexanoylthiophosphotidylcholine
TL;DR: 1,2-Hexanoylthiophosphotidylcholine (CAS 907958-42-3) is a chemical compound with molecular formula C20H40NO6PS2 and molecular weight 485.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis(hexanoylsulfanyl)propyl 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: Dhdtpc, Dic6-thiopc, 1,2-Hexanoylthiophosphotidylcholine, 4-Chloro-5-nitro-1H-indazole, 2,3-Bis(hexanoylthio)propylphosphocholine
| Molecular Formula | C20H40NO6PS2 |
|---|---|
| Molecular Weight | 485.20 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 485.20346 |
| Heavy Atoms | 30 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 907958-42-3 |
|---|---|
| SMILES | CCCCCC(=O)SCC(COP(=O)([O-])OCC[N+](C)(C)C)SC(=O)CCCCC |
| InChIKey | QPSMEAOJASLTHO-UHFFFAOYSA-N |
Product Overview
1,2-Hexanoylthiophosphotidylcholine (CAS 907958-42-3), with molecular formula C20H40NO6PS2 and molecular weight 485.20 g/mol. IUPAC: 2,3-bis(hexanoylsulfanyl)propyl 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of 1,2-Hexanoylthiophosphotidylcholine
Property Insights of 1,2-Hexanoylthiophosphotidylcholine
The XLogP value of 3.7 indicates that 1,2-Hexanoylthiophosphotidylcholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 143.0 Ų indicates high polarity, suggesting 1,2-Hexanoylthiophosphotidylcholine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2-Hexanoylthiophosphotidylcholine has 0 hydrogen bond donor(s) and 8 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 1,2-Hexanoylthiophosphotidylcholine?
The CAS number of 1,2-Hexanoylthiophosphotidylcholine is 907958-42-3.
What is the molecular formula of 1,2-Hexanoylthiophosphotidylcholine?
The molecular formula of 1,2-Hexanoylthiophosphotidylcholine is C20H40NO6PS2.
What is the molecular weight of 1,2-Hexanoylthiophosphotidylcholine?
The molecular weight of 1,2-Hexanoylthiophosphotidylcholine is 485.20 g/mol.
Where can I buy 1,2-Hexanoylthiophosphotidylcholine?
You can request a quote for 1,2-Hexanoylthiophosphotidylcholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Hexanoylthiophosphotidylcholine?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Hexanoylthiophosphotidylcholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.