BIM-0014546.P001
TL;DR: BIM-0014546.P001 (CAS 313249-37-5) is a chemical compound with molecular formula C13H9F3N4O2S and molecular weight 342.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-thiophen-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
Also Known As: BIM-0014546.P001, ethyl 5-(2-thienyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate, ethyl 5-thiophen-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate, ETHYL 5-(THIOPHEN-2-YL)-7-(TRIFLUOROMETHYL)-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-2-CARBOXYLATE, ethyl 5-(thiophen-2-yl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate
| Molecular Formula | C13H9F3N4O2S |
|---|---|
| Molecular Weight | 342.04 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.03983 |
| Heavy Atoms | 23 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 313249-37-5 |
|---|---|
| SMILES | CCOC(=O)C1=NN2C(=CC(=NC2=N1)C3=CC=CS3)C(F)(F)F |
| InChIKey | VEHORCUNEBEXNN-UHFFFAOYSA-N |
Product Overview
BIM-0014546.P001 (CAS 313249-37-5), with molecular formula C13H9F3N4O2S and molecular weight 342.04 g/mol. IUPAC: ethyl 5-thiophen-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate.
Chemical Property Profile of BIM-0014546.P001
Property Insights of BIM-0014546.P001
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0014546.P001. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0014546.P001. Following Lipinski's Rule of Five, BIM-0014546.P001 has 0 hydrogen bond donor(s) and 9 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 BIM-0014546.P001?
The CAS number of BIM-0014546.P001 is 313249-37-5.
What is the molecular formula of BIM-0014546.P001?
The molecular formula of BIM-0014546.P001 is C13H9F3N4O2S.
What is the molecular weight of BIM-0014546.P001?
The molecular weight of BIM-0014546.P001 is 342.04 g/mol.
Where can I buy BIM-0014546.P001?
You can request a quote for BIM-0014546.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0014546.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0014546.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.