ALLN
TL;DR: ALLN (CAS 110044-82-1) is a chemical compound with molecular formula C20H37N3O4 and molecular weight 383.2784 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-acetamido-4-methyl-N-[4-methyl-1-oxo-1-(1-oxohexan-2-ylamino)pentan-2-yl]pentanamide
Also Known As: ALLN, Calpain inhibitor I, Allnal, LLNL, InSolution™ ALLN
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H37N3O4 |
| Molecular Weight | 383.2784 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 383.2784 Da |
| Heavy Atoms | 27 |
| Complexity | 492.0 |
| SMILES | CCCCC(C=O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C |
| InChIKey | FMYKJLXRRQTBOR-UHFFFAOYSA-N |
Chemical Property Profile of ALLN
Property Insights of ALLN
The XLogP value of 3.0 indicates that ALLN is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ALLN. Following Lipinski's Rule of Five, ALLN has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ALLN?
The CAS number of ALLN is 110044-82-1.
What is the molecular formula of ALLN?
The molecular formula of ALLN is C20H37N3O4.
What is the molecular weight of ALLN?
The molecular weight of ALLN is 383.2784 g/mol.
Where can I buy ALLN?
You can request a quote for ALLN directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ALLN?
Yes, CoreyChem provides custom synthesis services for ALLN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.