RTI51
TL;DR: RTI51 (CAS 135367-08-7) is a chemical compound with molecular formula C16H20BrNO2 and molecular weight 337.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1S,2S,3S,5R)-3-(4-bromophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
Also Known As: RTI51, RTI 51, RTI4229-51, RTI-4229-51, Methyl (1R,2S,3S,5S)-3-(4-bromophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate
| Molecular Formula | C16H20BrNO2 |
|---|---|
| Molecular Weight | 337.07 g/mol |
| LogP | 3.1884 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.06775 |
| Heavy Atoms | 20 |
| Complexity | 501.70328 |
Chemical Identifiers
| CAS Number | 135367-08-7 |
|---|---|
| SMILES | CN1[C@@H]2CC[C@H]1[C@H]([C@H](C2)C3=CC=C(C=C3)Br)C(=O)OC |
Product Overview
RTI51 (CAS 135367-08-7), with molecular formula C16H20BrNO2 and molecular weight 337.07 g/mol. IUPAC: methyl (1S,2S,3S,5R)-3-(4-bromophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate.
Chemical Property Profile of RTI51
Property Insights of RTI51
The XLogP value of 3.1884 indicates that RTI51 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, RTI51 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RTI51 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RTI51?
The CAS number of RTI51 is 135367-08-7.
What is the molecular formula of RTI51?
The molecular formula of RTI51 is C16H20BrNO2.
What is the molecular weight of RTI51?
The molecular weight of RTI51 is 337.07 g/mol.
Where can I buy RTI51?
You can request a quote for RTI51 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RTI51?
Yes, KEHONG BIO provides custom synthesis services for RTI51 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.