Irtemazole
TL;DR: Irtemazole (CAS 115574-30-6) is a chemical compound with molecular formula C18H16N4 and molecular weight 288.13748 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[imidazol-1-yl(phenyl)methyl]-2-methyl-1H-benzimidazole
Also Known As: Irtemazole, Irtemazol, Irtemazolum, Irtemazole, (+)-, Irtemazole, (-)-
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H16N4 |
| Molecular Weight | 288.13748 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.13748 Da |
| Heavy Atoms | 22 |
| Complexity | 368.0 |
| SMILES | CC1=NC2=C(N1)C=C(C=C2)C(C3=CC=CC=C3)N4C=CN=C4 |
| InChIKey | DCGOMTSIZLGUOK-UHFFFAOYSA-N |
Chemical Property Profile of Irtemazole
Property Insights of Irtemazole
The XLogP value of 3.3 indicates that Irtemazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Irtemazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Irtemazole has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Irtemazole?
The CAS number of Irtemazole is 115574-30-6.
What is the molecular formula of Irtemazole?
The molecular formula of Irtemazole is C18H16N4.
What is the molecular weight of Irtemazole?
The molecular weight of Irtemazole is 288.13748 g/mol.
Where can I buy Irtemazole?
You can request a quote for Irtemazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Irtemazole?
Yes, CoreyChem provides custom synthesis services for Irtemazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.