AP-845/42429751
TL;DR: AP-845/42429751 (CAS 627043-66-7) is a chemical compound with molecular formula C16H12F3N3O2S and molecular weight 367.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide
Also Known As: AP-845/42429751, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[3-(trifluoromethyl)phenyl]-2-furamide
| Molecular Formula | C16H12F3N3O2S |
|---|---|
| Molecular Weight | 367.06 g/mol |
| LogP | 4.6316 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.06024 |
| Heavy Atoms | 25 |
| Complexity | 901.91956 |
Chemical Identifiers
| CAS Number | 627043-66-7 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
AP-845/42429751 (CAS 627043-66-7), with molecular formula C16H12F3N3O2S and molecular weight 367.06 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide.
Chemical Property Profile of AP-845/42429751
Property Insights of AP-845/42429751
The XLogP value of 4.6316 indicates that AP-845/42429751 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for AP-845/42429751. Following Lipinski's Rule of Five, AP-845/42429751 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 AP-845/42429751?
The CAS number of AP-845/42429751 is 627043-66-7.
What is the molecular formula of AP-845/42429751?
The molecular formula of AP-845/42429751 is C16H12F3N3O2S.
What is the molecular weight of AP-845/42429751?
The molecular weight of AP-845/42429751 is 367.06 g/mol.
Where can I buy AP-845/42429751?
You can request a quote for AP-845/42429751 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AP-845/42429751?
Yes, KEHONG BIO provides custom synthesis services for AP-845/42429751 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.