F0417-0894
TL;DR: F0417-0894 (CAS 392297-87-9) is a chemical compound with molecular formula C22H22FN5O4S3 and molecular weight 535.08 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]-4-piperidin-1-ylsulfonylbenzamide
Also Known As: F0417-0894, N-(5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-(piperidin-1-ylsulfonyl)benzamide, N-[5-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-4-(piperidine-1-sulfonyl)benzamide, N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-piperidin-1-ylsulfonylbenzamide
| Molecular Formula | C22H22FN5O4S3 |
|---|---|
| Molecular Weight | 535.08 g/mol |
| LogP | 3.8349 |
| Topological Polar Surface Area | 121.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 535.0818 |
| Heavy Atoms | 35 |
| Complexity | 1291.3853 |
Chemical Identifiers
| CAS Number | 392297-87-9 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)SCC(=O)NC4=CC=C(C=C4)F |
Product Overview
F0417-0894 (CAS 392297-87-9), with molecular formula C22H22FN5O4S3 and molecular weight 535.08 g/mol. IUPAC: N-[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-piperidin-1-ylsulfonylbenzamide.
Chemical Property Profile of F0417-0894
Property Insights of F0417-0894
The XLogP value of 3.8349 indicates that F0417-0894 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.36 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-0894. Following Lipinski's Rule of Five, F0417-0894 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0417-0894?
The CAS number of F0417-0894 is 392297-87-9.
What is the molecular formula of F0417-0894?
The molecular formula of F0417-0894 is C22H22FN5O4S3.
What is the molecular weight of F0417-0894?
The molecular weight of F0417-0894 is 535.08 g/mol.
Where can I buy F0417-0894?
You can request a quote for F0417-0894 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0894?
Yes, KEHONG BIO provides custom synthesis services for F0417-0894 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.