Sepimostat
TL;DR: Sepimostat (CAS 103926-64-3) is a chemical compound with molecular formula C21H19N5O2 and molecular weight 373.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-carbamimidoylnaphthalen-2-yl) 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate
Also Known As: Sepimostat, Sepimostat [INN], sepimostatum, Sepinostat, Sepimostat mesylate
| Molecular Formula | C21H19N5O2 |
|---|---|
| Molecular Weight | 373.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 373.15387 |
| Heavy Atoms | 28 |
| Complexity | 614.0 |
Chemical Identifiers
| CAS Number | 103926-64-3 |
|---|---|
| SMILES | C1CN=C(N1)NC2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)C(=N)N |
| InChIKey | QMRJOIUGPCVZPH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sepimostat (CAS 103926-64-3), with molecular formula C21H19N5O2 and molecular weight 373.15 g/mol. IUPAC: (6-carbamimidoylnaphthalen-2-yl) 4-(4,5-dihydro-1H-imidazol-2-ylamino)benzoate.
Chemical Property Profile of Sepimostat
Property Insights of Sepimostat
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sepimostat. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sepimostat. Following Lipinski's Rule of Five, Sepimostat has 4 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 Sepimostat?
The CAS number of Sepimostat is 103926-64-3.
What is the molecular formula of Sepimostat?
The molecular formula of Sepimostat is C21H19N5O2.
What is the molecular weight of Sepimostat?
The molecular weight of Sepimostat is 373.15 g/mol.
Where can I buy Sepimostat?
You can request a quote for Sepimostat directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sepimostat?
Yes, KEHONG BIO provides custom synthesis services for Sepimostat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.