R 59022
TL;DR: R 59022 (CAS 93076-89-2) is a chemical compound with molecular formula C27H26FN3OS and molecular weight 459.17807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Alisertib
6-[2-[4-[(4-fluorophenyl)-phenylmethylidene]piperidin-1-yl]ethyl]-7-methyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Also Known As: diacylglycerol kinase inhibitor i, Alisertib, R 59-022, DKGI-I, Lopac-D-5919
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C27H26FN3OS |
| Molecular Weight | 459.17807 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 61.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.17807 Da |
| Heavy Atoms | 33 |
| Complexity | 868.0 |
| SMILES | CC1=C(C(=O)N2C=CSC2=N1)CCN3CCC(=C(C4=CC=CC=C4)C5=CC=C(C=C5)F)CC3 |
| InChIKey | MFVJXLPANKSLLD-UHFFFAOYSA-N |
Product Description
Applications: R 59022 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 R 59022 (CAS 93076-89-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
R 59022 is a pharmaceutical intermediate identified by CAS number 93076-89-2 and the molecular formula C27H26FN3OS and a molecular weight of 459.18 g/mol. It is also known as diacylglycerol kinase inhibitor i and Alisertib.
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 R 59022
Property Insights of R 59022
The XLogP value of 5.1 indicates that R 59022 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.2 Ų falls within the moderate polarity range, balancing permeability and solubility for R 59022. Following Lipinski's Rule of Five, R 59022 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of R 59022?
The CAS number of R 59022 is 93076-89-2.
What is the molecular formula of R 59022?
The molecular formula of R 59022 is C27H26FN3OS.
What is the molecular weight of R 59022?
The molecular weight of R 59022 is 459.17807 g/mol.
What are the applications of R 59022?
R 59022 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 R 59022 (CAS 93076-89-2) with custom synthesis...
Where can I buy R 59022?
You can request a quote for R 59022 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for R 59022?
Yes, CoreyChem provides custom synthesis services for R 59022 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.