A3897/0165764
TL;DR: A3897/0165764 (CAS 728883-80-5) is a chemical compound with molecular formula C16H13F3N4O2S2 and molecular weight 414.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-methyl-2-[[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate
Also Known As: A3897/0165764, ethyl 4-methyl-2-((4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl)amino)thiazole-5-carboxylate, ethyl 4-methyl-2-[[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate, ETHYL 4-METHYL-2-{[4-(2-THIENYL)-6-(TRIFLUOROMETHYL)-2-PYRIMIDINYL]AMINO}-1,3-THIAZOLE-5-CARBOXYLATE, ethyl 4-methyl-2-{[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]amino}-1,3-thiazole-5-carboxylate
| Molecular Formula | C16H13F3N4O2S2 |
|---|---|
| Molecular Weight | 414.04 g/mol |
| LogP | 4.90912 |
| Topological Polar Surface Area | 77.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.0432 |
| Heavy Atoms | 27 |
| Complexity | 955.22876 |
Chemical Identifiers
| CAS Number | 728883-80-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)NC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3)C |
Product Overview
A3897/0165764 (CAS 728883-80-5), with molecular formula C16H13F3N4O2S2 and molecular weight 414.04 g/mol. IUPAC: ethyl 4-methyl-2-[[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]amino]-1,3-thiazole-5-carboxylate.
Chemical Property Profile of A3897/0165764
Property Insights of A3897/0165764
The XLogP value of 4.90912 indicates that A3897/0165764 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A3897/0165764. Following Lipinski's Rule of Five, A3897/0165764 has 1 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 A3897/0165764?
The CAS number of A3897/0165764 is 728883-80-5.
What is the molecular formula of A3897/0165764?
The molecular formula of A3897/0165764 is C16H13F3N4O2S2.
What is the molecular weight of A3897/0165764?
The molecular weight of A3897/0165764 is 414.04 g/mol.
Where can I buy A3897/0165764?
You can request a quote for A3897/0165764 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3897/0165764?
Yes, KEHONG BIO provides custom synthesis services for A3897/0165764 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.