F0417-1057
TL;DR: F0417-1057 (CAS 392299-32-0) is a chemical compound with molecular formula C23H21ClF3N5O4S3 and molecular weight 619.04 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-piperidin-1-ylsulfonylbenzamide
Also Known As: F0417-1057, N-{5-[({[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(piperidine-1-sulfonyl)benzamide, N-(5-((2-((2-chloro-5-(trifluoromethyl)phenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-(piperidin-1-ylsulfonyl)benzamide, N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-piperidin-1-ylsulfonylbenzamide
| Molecular Formula | C23H21ClF3N5O4S3 |
|---|---|
| Molecular Weight | 619.04 g/mol |
| LogP | 5.368 |
| Topological Polar Surface Area | 121.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 619.0396 |
| Heavy Atoms | 39 |
| Complexity | 1460.3809 |
Chemical Identifiers
| CAS Number | 392299-32-0 |
|---|---|
| SMILES | C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(S3)SCC(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl |
Product Overview
F0417-1057 (CAS 392299-32-0), with molecular formula C23H21ClF3N5O4S3 and molecular weight 619.04 g/mol. IUPAC: N-[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-piperidin-1-ylsulfonylbenzamide.
Chemical Property Profile of F0417-1057
Property Insights of F0417-1057
The XLogP value of 5.368 indicates that F0417-1057 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.36 Ų falls within the moderate polarity range, balancing permeability and solubility for F0417-1057. Following Lipinski's Rule of Five, F0417-1057 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 F0417-1057?
The CAS number of F0417-1057 is 392299-32-0.
What is the molecular formula of F0417-1057?
The molecular formula of F0417-1057 is C23H21ClF3N5O4S3.
What is the molecular weight of F0417-1057?
The molecular weight of F0417-1057 is 619.04 g/mol.
Where can I buy F0417-1057?
You can request a quote for F0417-1057 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0417-1057?
Yes, KEHONG BIO provides custom synthesis services for F0417-1057 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.