![methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate structure](/static/products/5249/524924-27-4.webp)
methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate
TL;DR: methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate (CAS 524924-27-4) is a chemical compound with molecular formula C12H7ClF3N3O3S and molecular weight 364.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-chloro-4-(trifluoromethyl)pyrimidine-5-carbonyl]amino]thiophene-3-carboxylate
Also Known As: methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate, Methyl 2-(([2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl)amino)thiophene-3-carboxylate, Methyl 2-[[2-chloro-4-(trifluoromethyl)pyrimidine-5-carbonyl]amino]thiophene-3-carboxylate, methyl 2-[2-chloro-4-(trifluoromethyl)pyrimidine-5-amido]thiophene-3-carboxylate
| Molecular Formula | C12H7ClF3N3O3S |
|---|---|
| Molecular Weight | 364.98 g/mol |
| LogP | 3.2492 |
| Topological Polar Surface Area | 81.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.98486 |
| Heavy Atoms | 23 |
| Complexity | 763.49457 |
Chemical Identifiers
| CAS Number | 524924-27-4 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1)NC(=O)C2=CN=C(N=C2C(F)(F)F)Cl |
Product Overview
methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate (CAS 524924-27-4), with molecular formula C12H7ClF3N3O3S and molecular weight 364.98 g/mol. IUPAC: methyl 2-[[2-chloro-4-(trifluoromethyl)pyrimidine-5-carbonyl]amino]thiophene-3-carboxylate.
Chemical Property Profile of methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate
Property Insights of methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate
The XLogP value of 3.2492 indicates that methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.18 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate has 1 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 methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate?
The CAS number of methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate is 524924-27-4.
What is the molecular formula of methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate?
The molecular formula of methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate is C12H7ClF3N3O3S.
What is the molecular weight of methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate?
The molecular weight of methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate is 364.98 g/mol.
Where can I buy methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate?
You can request a quote for methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate 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-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-({[2-chloro-4-(trifluoromethyl)pyrimidin-5-yl]carbonyl}amino)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.