F0417-1048
TL;DR: F0417-1048 (CAS 392299-25-1) is a chemical compound with molecular formula C20H16ClF3N4O4S2 and molecular weight 532.03 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]-2,4-dimethoxybenzamide
Also Known As: F0417-1048, N-(5-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2,4-dimethoxybenzamide, N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,4-dimethoxybenzamide, N-{5-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2,4-dimethoxybenzamide
| Molecular Formula | C20H16ClF3N4O4S2 |
|---|---|
| Molecular Weight | 532.03 g/mol |
| LogP | 5.2106 |
| Topological Polar Surface Area | 102.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 532.0253 |
| Heavy Atoms | 34 |
| Complexity | 1206.802 |
Chemical Identifiers
| CAS Number | 392299-25-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl)OC |
Product Overview
F0417-1048 (CAS 392299-25-1), with molecular formula C20H16ClF3N4O4S2 and molecular weight 532.03 g/mol. IUPAC: N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2,4-dimethoxybenzamide.
Chemical Property Profile of F0417-1048
Property Insights of F0417-1048
The XLogP value of 5.2106 indicates that F0417-1048 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.44 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-1048. Following Lipinski's Rule of Five, F0417-1048 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 F0417-1048?
The CAS number of F0417-1048 is 392299-25-1.
What is the molecular formula of F0417-1048?
The molecular formula of F0417-1048 is C20H16ClF3N4O4S2.
What is the molecular weight of F0417-1048?
The molecular weight of F0417-1048 is 532.03 g/mol.
Where can I buy F0417-1048?
You can request a quote for F0417-1048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-1048?
Yes, KEHONG BIO provides custom synthesis services for F0417-1048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.