Patamostat mesilate
TL;DR: Patamostat mesilate (CAS 114568-32-0) is a chemical compound with molecular formula C21H24N4O7S2 and molecular weight 508.10864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[2-(2,5-dioxopyrrolidin-1-yl)ethylsulfanyl]phenyl] 4-(diaminomethylideneamino)benzoate;methanesulfonic acid
Also Known As: Patamostat mesilate, Patamostat mesylate, Patomostat mesilate, Patamostat, Patamostat (mesylate)
Technical Specifications
| Molecular Formula | C21H24N4O7S2 |
| Molecular Weight | 508.10864 g/mol |
| XLogP | 1.5558 |
| Topological Polar Surface Area (TPSA) | 216.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 508.10864 Da |
| Heavy Atoms | 34 |
| Complexity | 713.0 |
| SMILES | CS(=O)(=O)O.C1CC(=O)N(C1=O)CCSC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)N=C(N)N |
| InChIKey | HTSFLDCSCNSKJW-UHFFFAOYSA-N |
Chemical Property Profile of Patamostat mesilate
Property Insights of Patamostat mesilate
The XLogP value of 1.5558 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Patamostat mesilate. The TPSA of 216.0 Ų indicates high polarity, suggesting Patamostat mesilate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Patamostat mesilate has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Patamostat mesilate?
The CAS number of Patamostat mesilate is 114568-32-0.
What is the molecular formula of Patamostat mesilate?
The molecular formula of Patamostat mesilate is C21H24N4O7S2.
What is the molecular weight of Patamostat mesilate?
The molecular weight of Patamostat mesilate is 508.10864 g/mol.
Where can I buy Patamostat mesilate?
You can request a quote for Patamostat mesilate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Patamostat mesilate?
Yes, CoreyChem provides custom synthesis services for Patamostat mesilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.