Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate
TL;DR: Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate (CAS 135026-49-2) is a chemical compound with molecular formula C10H13F3N2O2S and molecular weight 282.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(propan-2-ylamino)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
Also Known As: Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate, ethyl 2-(propan-2-ylamino)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate, 2-Isopropylamino-4-trifluoromethyl-thiazole-5-carboxylic acid ethyl ester, Ethyl2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate, ethyl 2-[(propan-2-yl)amino]-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
| Molecular Formula | C10H13F3N2O2S |
|---|---|
| Molecular Weight | 282.06 g/mol |
| LogP | 3.1589 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.06497 |
| Heavy Atoms | 18 |
| Complexity | 429.24756 |
Chemical Identifiers
| CAS Number | 135026-49-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)NC(C)C)C(F)(F)F |
Product Overview
Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate (CAS 135026-49-2), with molecular formula C10H13F3N2O2S and molecular weight 282.06 g/mol. IUPAC: ethyl 2-(propan-2-ylamino)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate.
Chemical Property Profile of Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate
Property Insights of Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate
The XLogP value of 3.1589 indicates that Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate has 1 hydrogen bond donor(s) and 5 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 Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate?
The CAS number of Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate is 135026-49-2.
What is the molecular formula of Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate?
The molecular formula of Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate is C10H13F3N2O2S.
What is the molecular weight of Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate?
The molecular weight of Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate is 282.06 g/mol.
Where can I buy Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate?
You can request a quote for Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(isopropylamino)-4-(trifluoromethyl)thiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.