F0417-1016
TL;DR: F0417-1016 (CAS 392299-00-2) is a chemical compound with molecular formula C19H14ClF3N4O2S2 and molecular weight 486.02 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]-3-methylbenzamide
Also Known As: F0417-1016, N-(5-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-methylbenzamide, N-{5-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-methylbenzamide, N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methylbenzamide
| Molecular Formula | C19H14ClF3N4O2S2 |
|---|---|
| Molecular Weight | 486.02 g/mol |
| LogP | 5.50182 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 486.01987 |
| Heavy Atoms | 31 |
| Complexity | 1121.5275 |
Chemical Identifiers
| CAS Number | 392299-00-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
F0417-1016 (CAS 392299-00-2), with molecular formula C19H14ClF3N4O2S2 and molecular weight 486.02 g/mol. IUPAC: N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methylbenzamide.
Chemical Property Profile of F0417-1016
Property Insights of F0417-1016
The XLogP value of 5.50182 indicates that F0417-1016 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 F0417-1016. Following Lipinski's Rule of Five, F0417-1016 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 F0417-1016?
The CAS number of F0417-1016 is 392299-00-2.
What is the molecular formula of F0417-1016?
The molecular formula of F0417-1016 is C19H14ClF3N4O2S2.
What is the molecular weight of F0417-1016?
The molecular weight of F0417-1016 is 486.02 g/mol.
Where can I buy F0417-1016?
You can request a quote for F0417-1016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-1016?
Yes, KEHONG BIO provides custom synthesis services for F0417-1016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.