ChemDiv2_003610
TL;DR: ChemDiv2_003610 (CAS 424803-64-5) is a chemical compound with molecular formula C18H14F2N4O2S3 and molecular weight 452.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-thiadiazol-3-yl]sulfanyl]-N-(4-fluorophenyl)acetamide
Also Known As: ChemDiv2_003610, IDI1_002325, BIM-0042940.P001, 2,2'-[1,2,4-thiadiazole-3,5-diylbis(thio)]bis[N-(4-fluorophenyl)acetamide], 2-[(3-{[2-(4-FLUOROANILINO)-2-OXOETHYL]SULFANYL}-1,2,4-THIADIAZOL-5-YL)SULFANYL]-N-(4-FLUOROPHENYL)ACETAMIDE
| Molecular Formula | C18H14F2N4O2S3 |
|---|---|
| Molecular Weight | 452.02 g/mol |
| LogP | 4.2779 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 452.0247 |
| Heavy Atoms | 29 |
| Complexity | 903.5311 |
Chemical Identifiers
| CAS Number | 424803-64-5 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)CSC2=NSC(=N2)SCC(=O)NC3=CC=C(C=C3)F)F |
Product Overview
ChemDiv2_003610 (CAS 424803-64-5), with molecular formula C18H14F2N4O2S3 and molecular weight 452.02 g/mol. IUPAC: 2-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-thiadiazol-3-yl]sulfanyl]-N-(4-fluorophenyl)acetamide.
Chemical Property Profile of ChemDiv2_003610
Property Insights of ChemDiv2_003610
The XLogP value of 4.2779 indicates that ChemDiv2_003610 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_003610. Following Lipinski's Rule of Five, ChemDiv2_003610 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 ChemDiv2_003610?
The CAS number of ChemDiv2_003610 is 424803-64-5.
What is the molecular formula of ChemDiv2_003610?
The molecular formula of ChemDiv2_003610 is C18H14F2N4O2S3.
What is the molecular weight of ChemDiv2_003610?
The molecular weight of ChemDiv2_003610 is 452.02 g/mol.
Where can I buy ChemDiv2_003610?
You can request a quote for ChemDiv2_003610 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_003610?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_003610 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.