Nafamostat mesylate
TL;DR: Nafamostat mesylate (CAS 1041927-73-4) is a chemical compound with molecular formula C20H21N5O5S and molecular weight 443.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-carbamimidoylnaphthalen-2-yl) 4-(diaminomethylideneamino)benzoate;methanesulfonic acid
Also Known As: Nafamostat mesylate, 5-Amino-2-chlorobenzoicacid, Tox21_111787, Tox21_111787_1, CAS-82956-11-4
| Molecular Formula | C20H21N5O5S |
|---|---|
| Molecular Weight | 443.13 g/mol |
| LogP | 1.75197 |
| Topological Polar Surface Area | 194.94 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.12634 |
| Heavy Atoms | 31 |
| Complexity | 1242.6957 |
Chemical Identifiers
| CAS Number | 1041927-73-4 |
|---|---|
| SMILES | CS(=O)(=O)O.C1=CC(=CC=C1C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)N=C(N)N |
Product Overview
Nafamostat mesylate (CAS 1041927-73-4), with molecular formula C20H21N5O5S and molecular weight 443.13 g/mol. IUPAC: (6-carbamimidoylnaphthalen-2-yl) 4-(diaminomethylideneamino)benzoate;methanesulfonic acid.
Chemical Property Profile of Nafamostat mesylate
Property Insights of Nafamostat mesylate
The XLogP value of 1.75197 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nafamostat mesylate. The TPSA of 194.94 Ų indicates high polarity, suggesting Nafamostat mesylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Nafamostat mesylate has 5 hydrogen bond donor(s) and 6 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 Nafamostat mesylate?
The CAS number of Nafamostat mesylate is 1041927-73-4.
What is the molecular formula of Nafamostat mesylate?
The molecular formula of Nafamostat mesylate is C20H21N5O5S.
What is the molecular weight of Nafamostat mesylate?
The molecular weight of Nafamostat mesylate is 443.13 g/mol.
Where can I buy Nafamostat mesylate?
You can request a quote for Nafamostat mesylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nafamostat mesylate?
Yes, KEHONG BIO provides custom synthesis services for Nafamostat mesylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.