Mocoht
TL;DR: Mocoht (CAS 111878-47-8) is a chemical compound with molecular formula C33H59BrN2O4S and molecular weight 658.3379 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(octadecylcarbamoyloxymethyl)prop-2-enyl 7-(1,3-thiazol-3-ium-3-yl)heptanoate bromide
Also Known As: Mocoht, Mocoht bromide, PD 124966, 3-{7-[(2-{[(octadecylcarbamoyl)oxy]methyl}prop-2-en-1-yl)oxy]-7-oxoheptyl}-1,3-thiazol-3-ium bromide, L 156602
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C33H59BrN2O4S |
| Molecular Weight | 658.3379 g/mol |
| XLogP | 6.0772 |
| Topological Polar Surface Area (TPSA) | 96.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 30 |
| Exact Mass | 658.3379 Da |
| Heavy Atoms | 41 |
| Complexity | 632.0 |
| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)OCC(=C)COC(=O)CCCCCC[N+]1=CSC=C1.[Br-] |
| InChIKey | AGTKBDKZOLNSON-UHFFFAOYSA-N |
Chemical Property Profile of Mocoht
Property Insights of Mocoht
The XLogP value of 6.0772 indicates that Mocoht is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Mocoht. Following Lipinski's Rule of Five, Mocoht has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Mocoht?
The CAS number of Mocoht is 111878-47-8.
What is the molecular formula of Mocoht?
The molecular formula of Mocoht is C33H59BrN2O4S.
What is the molecular weight of Mocoht?
The molecular weight of Mocoht is 658.3379 g/mol.
Where can I buy Mocoht?
You can request a quote for Mocoht directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mocoht?
Yes, CoreyChem provides custom synthesis services for Mocoht and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.