A-192558
TL;DR: A-192558 (CAS 341969-96-8) is a chemical compound with molecular formula C14H23F3N4O4 and molecular weight 368.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4R,5S)-4-amino-1-[ethyl(propan-2-yl)carbamoyl]-5-[[(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidine-3-carboxylic acid
Also Known As: J1.538.304F, 3-Pyrrolidinecarboxylic acid, 4-amino-1-((ethyl(1-methylethyl)amino)carbonyl)-5-(((trifluoroacetyl)amino)methyl)-, (3R,4R,5S)-, 3-Pyrrolidinecarboxylic acid, 4-amino-1-((ethyl(1-methylethyl)amino)carbonyl)-5-(((2,2,2-trifluoroacetyl)amino)methyl)-, (3R,4R,5S)-, (3R,4R,5S)-4-Amino-1-[ethyl(propan-2-yl)carbamoyl]-5-[[(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidine-3-carboxylic acid, (3R,4R,5S)-4-amino-1-[ethyl(propan-2-yl)carbamoyl]-5-[(2,2,2-trifluoroacetamido)methyl]pyrrolidine-3-carboxylic acid
| Molecular Formula | C14H23F3N4O4 |
|---|---|
| Molecular Weight | 368.17 g/mol |
| LogP | 0.2275 |
| Topological Polar Surface Area | 115.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.16714 |
| Heavy Atoms | 25 |
| Complexity | 526.6965 |
Chemical Identifiers
| CAS Number | 341969-96-8 |
|---|---|
| SMILES | CCN(C(C)C)C(=O)N1C[C@H]([C@H]([C@@H]1CNC(=O)C(F)(F)F)N)C(=O)O |
Product Overview
A-192558 (CAS 341969-96-8), with molecular formula C14H23F3N4O4 and molecular weight 368.17 g/mol. IUPAC: (3R,4R,5S)-4-amino-1-[ethyl(propan-2-yl)carbamoyl]-5-[[(2,2,2-trifluoroacetyl)amino]methyl]pyrrolidine-3-carboxylic acid.
Chemical Property Profile of A-192558
Property Insights of A-192558
The XLogP value of 0.2275 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A-192558. The TPSA of 115.97 Ų falls within the moderate polarity range, balancing permeability and solubility for A-192558. Following Lipinski's Rule of Five, A-192558 has 3 hydrogen bond donor(s) and 4 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 A-192558?
The CAS number of A-192558 is 341969-96-8.
What is the molecular formula of A-192558?
The molecular formula of A-192558 is C14H23F3N4O4.
What is the molecular weight of A-192558?
The molecular weight of A-192558 is 368.17 g/mol.
Where can I buy A-192558?
You can request a quote for A-192558 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A-192558?
Yes, KEHONG BIO provides custom synthesis services for A-192558 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.