AJ-292/13605017
TL;DR: AJ-292/13605017 (CAS 313481-81-1) is a chemical compound with molecular formula C24H24F3N3O4 and molecular weight 475.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2,5-dioxo-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidin-1-yl]benzoate
Also Known As: AJ-292/13605017, ethyl 4-(2,5-dioxo-3-{4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}-1-pyrrolidinyl)benzoate, ethyl 4-[2,5-dioxo-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidin-1-yl]benzoate, ethyl 4-(2,5-dioxo-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}pyrrolidin-1-yl)benzoate, ethyl 4-(2,5-dioxo-3-{4-[3-(trifluoromethyl)phenyl]piperazino}-1-pyrrolidinyl)benzoate
| Molecular Formula | C24H24F3N3O4 |
|---|---|
| Molecular Weight | 475.17 g/mol |
| LogP | 3.3362 |
| Topological Polar Surface Area | 70.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.1719 |
| Heavy Atoms | 34 |
| Complexity | 1079.616 |
Chemical Identifiers
| CAS Number | 313481-81-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F |
Product Overview
AJ-292/13605017 (CAS 313481-81-1), with molecular formula C24H24F3N3O4 and molecular weight 475.17 g/mol. IUPAC: ethyl 4-[2,5-dioxo-3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrrolidin-1-yl]benzoate.
Chemical Property Profile of AJ-292/13605017
Property Insights of AJ-292/13605017
The XLogP value of 3.3362 indicates that AJ-292/13605017 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AJ-292/13605017. Following Lipinski's Rule of Five, AJ-292/13605017 has 0 hydrogen bond donor(s) and 6 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 AJ-292/13605017?
The CAS number of AJ-292/13605017 is 313481-81-1.
What is the molecular formula of AJ-292/13605017?
The molecular formula of AJ-292/13605017 is C24H24F3N3O4.
What is the molecular weight of AJ-292/13605017?
The molecular weight of AJ-292/13605017 is 475.17 g/mol.
Where can I buy AJ-292/13605017?
You can request a quote for AJ-292/13605017 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AJ-292/13605017?
Yes, KEHONG BIO provides custom synthesis services for AJ-292/13605017 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.