F0417-0889
TL;DR: F0417-0889 (CAS 392297-83-5) is a chemical compound with molecular formula C23H25FN4O5S2 and molecular weight 520.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-triethoxy-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-0889, 3,4,5-triethoxy-N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, 3,4,5-triethoxy-N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide, 3,4,5-triethoxy-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide, 3,4,5-triethoxy-N-[5-[(4-fluorophenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C23H25FN4O5S2 |
|---|---|
| Molecular Weight | 520.13 g/mol |
| LogP | 4.8564 |
| Topological Polar Surface Area | 111.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 520.12506 |
| Heavy Atoms | 35 |
| Complexity | 1130.0635 |
Chemical Identifiers
| CAS Number | 392297-83-5 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=C(C=C3)F |
Product Overview
F0417-0889 (CAS 392297-83-5), with molecular formula C23H25FN4O5S2 and molecular weight 520.13 g/mol. IUPAC: 3,4,5-triethoxy-N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of F0417-0889
Property Insights of F0417-0889
The XLogP value of 4.8564 indicates that F0417-0889 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 F0417-0889. Following Lipinski's Rule of Five, F0417-0889 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0417-0889?
The CAS number of F0417-0889 is 392297-83-5.
What is the molecular formula of F0417-0889?
The molecular formula of F0417-0889 is C23H25FN4O5S2.
What is the molecular weight of F0417-0889?
The molecular weight of F0417-0889 is 520.13 g/mol.
Where can I buy F0417-0889?
You can request a quote for F0417-0889 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0889?
Yes, KEHONG BIO provides custom synthesis services for F0417-0889 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.