ChemDiv1_014352
TL;DR: ChemDiv1_014352 (CAS 389073-16-9) is a chemical compound with molecular formula C20H19FN4O5S2 and molecular weight 478.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4,5-trimethoxybenzamide
Also Known As: ChemDiv1_014352, F0509-3280, N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,4,5-trimethoxybenzamide, N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3,4,5-trimethoxybenzamide, N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4,5-trimethoxybenzamide
| Molecular Formula | C20H19FN4O5S2 |
|---|---|
| Molecular Weight | 478.08 g/mol |
| LogP | 3.6861 |
| Topological Polar Surface Area | 111.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 478.0781 |
| Heavy Atoms | 32 |
| Complexity | 1082.6196 |
Chemical Identifiers
| CAS Number | 389073-16-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F |
Product Overview
ChemDiv1_014352 (CAS 389073-16-9), with molecular formula C20H19FN4O5S2 and molecular weight 478.08 g/mol. IUPAC: N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4,5-trimethoxybenzamide.
Chemical Property Profile of ChemDiv1_014352
Property Insights of ChemDiv1_014352
The XLogP value of 3.6861 indicates that ChemDiv1_014352 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.67 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_014352. Following Lipinski's Rule of Five, ChemDiv1_014352 has 2 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 ChemDiv1_014352?
The CAS number of ChemDiv1_014352 is 389073-16-9.
What is the molecular formula of ChemDiv1_014352?
The molecular formula of ChemDiv1_014352 is C20H19FN4O5S2.
What is the molecular weight of ChemDiv1_014352?
The molecular weight of ChemDiv1_014352 is 478.08 g/mol.
Where can I buy ChemDiv1_014352?
You can request a quote for ChemDiv1_014352 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014352?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014352 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.