Entinostat
TL;DR: Entinostat (CAS 209783-80-2) is a chemical compound with molecular formula C21H20N4O3 and molecular weight 376.15353 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyridin-3-ylmethyl N-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]carbamate
Also Known As: Entinostat, entinostatum, Entinostat (MS-275), Entinostat, free base, MS 275
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H20N4O3 |
| Molecular Weight | 376.15353 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.15353 Da |
| Heavy Atoms | 28 |
| Complexity | 508.0 |
| SMILES | C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=O)OCC3=CN=CC=C3 |
| InChIKey | INVTYAOGFAGBOE-UHFFFAOYSA-N |
Product Description
Applications: Entinostat is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Entinostat (CAS 209783-80-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Entinostat (CAS 209783-80-2) has the molecular formula C21H20N4O3 and a molecular weight of 376.15 g/mol. It is also known as Entinostat and ms-275.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Entinostat
Property Insights of Entinostat
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Entinostat. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Entinostat. Following Lipinski's Rule of Five, Entinostat has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Entinostat?
The CAS number of Entinostat is 209783-80-2.
What is the molecular formula of Entinostat?
The molecular formula of Entinostat is C21H20N4O3.
What is the molecular weight of Entinostat?
The molecular weight of Entinostat is 376.15353 g/mol.
What are the applications of Entinostat?
Entinostat is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Entinostat (CAS 209783-80-2) with custom...
Where can I buy Entinostat?
You can request a quote for Entinostat directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Entinostat?
Yes, CoreyChem provides custom synthesis services for Entinostat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.