Mocpcp
TL;DR: Mocpcp (CAS 736893-99-5) is a chemical compound with molecular formula C34H59N2O4+ and molecular weight 559.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(octadecylcarbamoyloxymethyl)prop-2-enyl 6-pyridin-1-ium-1-ylhexanoate
Also Known As: Mocpcp, Xylenol Blue, 1-{6-[(2-{[(octadecylcarbamoyl)oxy]methyl}prop-2-en-1-yl)oxy]-6-oxohexyl}pyridinium, 2-(octadecylcarbamoyloxymethyl)prop-2-enyl 6-pyridin-1-ylhexanoate, N-(5-((2-Methylene-3-(((octadecylamino)carbonyl)oxy)propoxy)carbonyl)pentyl)pyridinium
| Molecular Formula | C34H59N2O4+ |
|---|---|
| Molecular Weight | 559.45 g/mol |
| LogP | 11.1 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 29 |
| Exact Mass | 559.4475 |
| Heavy Atoms | 40 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 736893-99-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)OCC(=C)COC(=O)CCCCC[N+]1=CC=CC=C1 |
| InChIKey | LUEXYWXHKONSPA-UHFFFAOYSA-O |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mocpcp (CAS 736893-99-5), with molecular formula C34H59N2O4+ and molecular weight 559.45 g/mol. IUPAC: 2-(octadecylcarbamoyloxymethyl)prop-2-enyl 6-pyridin-1-ium-1-ylhexanoate.
Chemical Property Profile of Mocpcp
Property Insights of Mocpcp
The XLogP value of 11.1 indicates that Mocpcp is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Mocpcp. Following Lipinski's Rule of Five, Mocpcp has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mocpcp?
The CAS number of Mocpcp is 736893-99-5.
What is the molecular formula of Mocpcp?
The molecular formula of Mocpcp is C34H59N2O4+.
What is the molecular weight of Mocpcp?
The molecular weight of Mocpcp is 559.45 g/mol.
Where can I buy Mocpcp?
You can request a quote for Mocpcp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mocpcp?
Yes, KEHONG BIO provides custom synthesis services for Mocpcp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.