F0417-0291
TL;DR: F0417-0291 (CAS 392293-25-3) is a chemical compound with molecular formula C21H17F3N4O4S2 and molecular weight 510.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-[[5-[[3-(trifluoromethyl)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: F0417-0291, ethyl 4-(2-((5-(3-(trifluoromethyl)benzamido)-1,3,4-thiadiazol-2-yl)thio)acetamido)benzoate, ethyl 4-[2-({5-[3-(trifluoromethyl)benzamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate, ethyl 4-[[2-[[5-[[3-(trifluoromethyl)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate
| Molecular Formula | C21H17F3N4O4S2 |
|---|---|
| Molecular Weight | 510.06 g/mol |
| LogP | 4.7167 |
| Topological Polar Surface Area | 110.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 510.06433 |
| Heavy Atoms | 34 |
| Complexity | 1183.2616 |
Chemical Identifiers
| CAS Number | 392293-25-3 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
F0417-0291 (CAS 392293-25-3), with molecular formula C21H17F3N4O4S2 and molecular weight 510.06 g/mol. IUPAC: ethyl 4-[[2-[[5-[[3-(trifluoromethyl)benzoyl]amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]benzoate.
Chemical Property Profile of F0417-0291
Property Insights of F0417-0291
The XLogP value of 4.7167 indicates that F0417-0291 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.28 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-0291. Following Lipinski's Rule of Five, F0417-0291 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 F0417-0291?
The CAS number of F0417-0291 is 392293-25-3.
What is the molecular formula of F0417-0291?
The molecular formula of F0417-0291 is C21H17F3N4O4S2.
What is the molecular weight of F0417-0291?
The molecular weight of F0417-0291 is 510.06 g/mol.
Where can I buy F0417-0291?
You can request a quote for F0417-0291 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-0291?
Yes, KEHONG BIO provides custom synthesis services for F0417-0291 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.