F0417-1033
TL;DR: F0417-1033 (CAS 392299-17-1) is a chemical compound with molecular formula C20H16ClF3N4O3S2 and molecular weight 516.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxybenzamide
Also Known As: F0417-1033, N-(5-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-ethoxybenzamide, N-{5-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-ethoxybenzamide, N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxybenzamide
| Molecular Formula | C20H16ClF3N4O3S2 |
|---|---|
| Molecular Weight | 516.03 g/mol |
| LogP | 5.5921 |
| Topological Polar Surface Area | 93.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 516.03046 |
| Heavy Atoms | 33 |
| Complexity | 1140.3289 |
Chemical Identifiers
| CAS Number | 392299-17-1 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
F0417-1033 (CAS 392299-17-1), with molecular formula C20H16ClF3N4O3S2 and molecular weight 516.03 g/mol. IUPAC: N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-ethoxybenzamide.
Chemical Property Profile of F0417-1033
Property Insights of F0417-1033
The XLogP value of 5.5921 indicates that F0417-1033 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.21 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-1033. Following Lipinski's Rule of Five, F0417-1033 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0417-1033?
The CAS number of F0417-1033 is 392299-17-1.
What is the molecular formula of F0417-1033?
The molecular formula of F0417-1033 is C20H16ClF3N4O3S2.
What is the molecular weight of F0417-1033?
The molecular weight of F0417-1033 is 516.03 g/mol.
Where can I buy F0417-1033?
You can request a quote for F0417-1033 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-1033?
Yes, KEHONG BIO provides custom synthesis services for F0417-1033 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.