RefChem:1056876
TL;DR: RefChem:1056876 (CAS 53103-52-9) is a chemical compound with molecular formula C15H26NO4P and molecular weight 315.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylpropyl 3-(trimethylazaniumyl)propyl phosphate
Also Known As: Phenyl-1-ethyl-1-methylphosphate d'homocholine, 1-phenylpropyl 3-(trimethylazaniumyl)propyl phosphate, Phenyl-1-ethyl-1-methylphosphate d'homocholine [French], 1-Propanaminium, 3-((hydroxy(1-phenylpropoxy)phosphinyl)oxy)-N,N,N-trimethyl-, hydroxide, inner salt, RefChem:1056876
| Molecular Formula | C15H26NO4P |
|---|---|
| Molecular Weight | 315.16 g/mol |
| LogP | 2.7356 |
| Topological Polar Surface Area | 58.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 315.15994 |
| Heavy Atoms | 21 |
| Complexity | 458.49146 |
Chemical Identifiers
| CAS Number | 53103-52-9 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)OP(=O)([O-])OCCC[N+](C)(C)C |
Product Overview
RefChem:1056876 (CAS 53103-52-9), with molecular formula C15H26NO4P and molecular weight 315.16 g/mol. IUPAC: 1-phenylpropyl 3-(trimethylazaniumyl)propyl phosphate.
Chemical Property Profile of RefChem:1056876
Property Insights of RefChem:1056876
The XLogP value of 2.7356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1056876. With a topological polar surface area (TPSA) of 58.59 Ų, RefChem:1056876 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1056876 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 RefChem:1056876?
The CAS number of RefChem:1056876 is 53103-52-9.
What is the molecular formula of RefChem:1056876?
The molecular formula of RefChem:1056876 is C15H26NO4P.
What is the molecular weight of RefChem:1056876?
The molecular weight of RefChem:1056876 is 315.16 g/mol.
Where can I buy RefChem:1056876?
You can request a quote for RefChem:1056876 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056876?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056876 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.