Temozolomide
TL;DR: Temozolomide (CAS 85622-93-1) is a chemical compound with molecular formula C6H6N6O2 and molecular weight 194.05522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-4-oxoimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide
Also Known As: temozolomide, Methazolastone, Temodar, Temodal, Temozolamide
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H6N6O2 |
| Molecular Weight | 194.05522 g/mol |
| XLogP | -1.1 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.05522 Da |
| Heavy Atoms | 14 |
| Complexity | 315.0 |
| Melting Point | 212 |
| Solubility | 5.09 |
| SMILES | CN1C(=O)N2C=NC(=C2N=N1)C(=O)N |
| InChIKey | BPEGJWRSRHCHSN-UHFFFAOYSA-N |
Product Description
Applications: Temozolomide 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Temozolomide is a pharmaceutical intermediate identified by CAS number 85622-93-1 and the molecular formula C6H6N6O2 and a molecular weight of 194.06 g/mol. Physically, the compound has a solubility: 5.09. Synonyms include temozolomide and Methazolastone.
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 Temozolomide
Property Insights of Temozolomide
The XLogP value of -1.1 indicates that Temozolomide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Temozolomide. Following Lipinski's Rule of Five, Temozolomide has 1 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 Temozolomide?
The CAS number of Temozolomide is 85622-93-1.
What is the molecular formula of Temozolomide?
The molecular formula of Temozolomide is C6H6N6O2.
What is the molecular weight of Temozolomide?
The molecular weight of Temozolomide is 194.05522 g/mol.
What are the applications of Temozolomide?
Temozolomide 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. Available from CoreyChem as both catalog item and...
Where can I buy Temozolomide?
You can request a quote for Temozolomide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Temozolomide?
Yes, CoreyChem provides custom synthesis services for Temozolomide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.