F0417-0131
TL;DR: F0417-0131 (CAS 392291-61-1) is a chemical compound with molecular formula C25H22N4O2S2 and molecular weight 474.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-N-[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: F0417-0131, 4-benzyl-N-[5-({[(4-methylphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide, 4-benzyl-N-(5-((2-oxo-2-(p-tolylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide, 4-benzyl-N-[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide, 4-benzyl-N-[5-[(4-methylphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C25H22N4O2S2 |
|---|---|
| Molecular Weight | 474.12 g/mol |
| LogP | 5.42042 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 474.1184 |
| Heavy Atoms | 33 |
| Complexity | 1223.5237 |
Chemical Identifiers
| CAS Number | 392291-61-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)CC4=CC=CC=C4 |
Product Overview
F0417-0131 (CAS 392291-61-1), with molecular formula C25H22N4O2S2 and molecular weight 474.12 g/mol. IUPAC: 4-benzyl-N-[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of F0417-0131
Property Insights of F0417-0131
The XLogP value of 5.42042 indicates that F0417-0131 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 F0417-0131. Following Lipinski's Rule of Five, F0417-0131 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0417-0131?
The CAS number of F0417-0131 is 392291-61-1.
What is the molecular formula of F0417-0131?
The molecular formula of F0417-0131 is C25H22N4O2S2.
What is the molecular weight of F0417-0131?
The molecular weight of F0417-0131 is 474.12 g/mol.
Where can I buy F0417-0131?
You can request a quote for F0417-0131 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0131?
Yes, KEHONG BIO provides custom synthesis services for F0417-0131 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.