A2811/0118884
TL;DR: A2811/0118884 (CAS 446053-07-2) is a chemical compound with molecular formula C19H20F3N3O3 and molecular weight 395.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(4,6-dimethyl-2-pyridinyl)amino]-3,3,3-trifluoro-2-[(4-methylbenzoyl)amino]propanoate
Also Known As: A2811/0118884, Methyl 2-[(4,6-dimethyl-2-pyridinyl)amino]-3,3,3-trifluoro-2-[(4-methylbenzoyl)amino]propanoate, methyl 2-[(4,6-dimethylpyridin-2-yl)amino]-3,3,3-trifluoro-2-[(4-methylbenzoyl)amino]propanoate, methyl 2-((4,6-dimethylpyridin-2-yl)amino)-3,3,3-trifluoro-2-(4-methylbenzamido)propanoate, 2-(4,6-Dimethyl-pyridin-2-ylamino)-3,3,3-trifluoro-2-(4-methyl-benzoylamino)-propionic acid methyl ester
| Molecular Formula | C19H20F3N3O3 |
|---|---|
| Molecular Weight | 395.15 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.1457 |
| Heavy Atoms | 28 |
| Complexity | 564.0 |
Chemical Identifiers
| CAS Number | 446053-07-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC(C(=O)OC)(C(F)(F)F)NC2=CC(=CC(=N2)C)C |
| InChIKey | QZELCGVFMMBQBT-UHFFFAOYSA-N |
Product Overview
A2811/0118884 (CAS 446053-07-2), with molecular formula C19H20F3N3O3 and molecular weight 395.15 g/mol. IUPAC: methyl 2-[(4,6-dimethyl-2-pyridinyl)amino]-3,3,3-trifluoro-2-[(4-methylbenzoyl)amino]propanoate.
Chemical Property Profile of A2811/0118884
Property Insights of A2811/0118884
The XLogP value of 4.8 indicates that A2811/0118884 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for A2811/0118884. Following Lipinski's Rule of Five, A2811/0118884 has 2 hydrogen bond donor(s) and 8 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 A2811/0118884?
The CAS number of A2811/0118884 is 446053-07-2.
What is the molecular formula of A2811/0118884?
The molecular formula of A2811/0118884 is C19H20F3N3O3.
What is the molecular weight of A2811/0118884?
The molecular weight of A2811/0118884 is 395.15 g/mol.
Where can I buy A2811/0118884?
You can request a quote for A2811/0118884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2811/0118884?
Yes, KEHONG BIO provides custom synthesis services for A2811/0118884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.