R 79882
TL;DR: R 79882 (CAS 149206-69-9) is a chemical compound with molecular formula C16H21N3O and molecular weight 271.16846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-methyl-10-(3-methylbut-2-enyl)-1,3,10-triazatricyclo[6.4.1.04,13]trideca-4,6,8(13)-trien-2-one
Also Known As: O-Tibo, TIBO, R 79882, methyl(3-methylbut-2-enyl)[?]one, R-79882
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H21N3O |
| Molecular Weight | 271.16846 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.16846 Da |
| Heavy Atoms | 20 |
| Complexity | 416.0 |
| SMILES | CC1CN2C3=C(CN1CC=C(C)C)C=CC=C3NC2=O |
| InChIKey | LOFKLFWOTPCHJG-UHFFFAOYSA-N |
Chemical Property Profile of R 79882
Property Insights of R 79882
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for R 79882. With a topological polar surface area (TPSA) of 35.6 Ų, R 79882 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, R 79882 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 R 79882?
The CAS number of R 79882 is 149206-69-9.
What is the molecular formula of R 79882?
The molecular formula of R 79882 is C16H21N3O.
What is the molecular weight of R 79882?
The molecular weight of R 79882 is 271.16846 g/mol.
Where can I buy R 79882?
You can request a quote for R 79882 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for R 79882?
Yes, CoreyChem provides custom synthesis services for R 79882 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.