ChemDiv1_014218
TL;DR: ChemDiv1_014218 (CAS 389072-82-6) is a chemical compound with molecular formula C20H17F3N4O3S2 and molecular weight 482.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide
Also Known As: ChemDiv1_014218, 2-({5-[2-(4-methoxyphenyl)acetamido]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-[2-(trifluoromethyl)phenyl]acetamide, F0417-0758, 2-(4-methoxyphenyl)-N-(5-((2-oxo-2-((2-(trifluoromethyl)phenyl)amino)ethyl)thio)-1,3,4-thiadiazol-2-yl)acetamide, 2-(4-methoxyphenyl)-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide
| Molecular Formula | C20H17F3N4O3S2 |
|---|---|
| Molecular Weight | 482.07 g/mol |
| LogP | 4.4775 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 482.06943 |
| Heavy Atoms | 32 |
| Complexity | 1088.1941 |
Chemical Identifiers
| CAS Number | 389072-82-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3C(F)(F)F |
Product Overview
ChemDiv1_014218 (CAS 389072-82-6), with molecular formula C20H17F3N4O3S2 and molecular weight 482.07 g/mol. IUPAC: 2-(4-methoxyphenyl)-N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide.
Chemical Property Profile of ChemDiv1_014218
Property Insights of ChemDiv1_014218
The XLogP value of 4.4775 indicates that ChemDiv1_014218 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.21 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014218. Following Lipinski's Rule of Five, ChemDiv1_014218 has 2 hydrogen bond donor(s) and 7 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 ChemDiv1_014218?
The CAS number of ChemDiv1_014218 is 389072-82-6.
What is the molecular formula of ChemDiv1_014218?
The molecular formula of ChemDiv1_014218 is C20H17F3N4O3S2.
What is the molecular weight of ChemDiv1_014218?
The molecular weight of ChemDiv1_014218 is 482.07 g/mol.
Where can I buy ChemDiv1_014218?
You can request a quote for ChemDiv1_014218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014218?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.