![Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate structure](/static/products/488/488802-57-9.png)
Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate
TL;DR: Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate (CAS 488802-57-9) is a chemical compound with molecular formula C15H12Cl2F3N3O3S and molecular weight 440.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate
Also Known As: Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate, 2-(2,4-Dichloro-benzoylamino)-3,3,3-trifluoro-2-(4-methyl-thiazol-2-ylamino)-propionic acid methyl ester, (S)-methyl 2-(2,4-dichlorobenzamido)-3,3,3-trifluoro-2-((4-methylthiazol-2-yl)amino)propanoate, Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate #, methyl N-[(2,4-dichlorophenyl)carbonyl]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]alaninate
| Molecular Formula | C15H12Cl2F3N3O3S |
|---|---|
| Molecular Weight | 440.99 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.99286 |
| Heavy Atoms | 27 |
| Complexity | 572.0 |
Chemical Identifiers
| CAS Number | 488802-57-9 |
|---|---|
| SMILES | CC1=CSC(=N1)NC(C(=O)OC)(C(F)(F)F)NC(=O)C2=C(C=C(C=C2)Cl)Cl |
| InChIKey | LPPIIVNZHNOVOX-UHFFFAOYSA-N |
Product Overview
Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate (CAS 488802-57-9), with molecular formula C15H12Cl2F3N3O3S and molecular weight 440.99 g/mol. IUPAC: methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate.
Chemical Property Profile of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate
Property Insights of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate
The XLogP value of 5.4 indicates that Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate. Following Lipinski's Rule of Five, Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate?
The CAS number of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate is 488802-57-9.
What is the molecular formula of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate?
The molecular formula of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate is C15H12Cl2F3N3O3S.
What is the molecular weight of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate?
The molecular weight of Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate is 440.99 g/mol.
Where can I buy Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate?
You can request a quote for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[(2,4-dichlorobenzoyl)amino]-3,3,3-trifluoro-2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.