A1168/0054367
TL;DR: A1168/0054367 (CAS 311333-07-0) is a chemical compound with molecular formula C24H22FN3OS and molecular weight 419.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridinyl]sulfanyl]acetamide
Also Known As: A1168/0054367, N-tert-butyl-2-{[3-cyano-4-(4-fluorophenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide, N-(tert-butyl)-2-((3-cyano-4-(4-fluorophenyl)-6-phenylpyridin-2-yl)thio)acetamide, N-tert-butyl-2-[3-cyano-4-(4-fluorophenyl)-6-phenylpyridin-2-yl]sulfanylacetamide
| Molecular Formula | C24H22FN3OS |
|---|---|
| Molecular Weight | 419.15 g/mol |
| LogP | 5.43318 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.14676 |
| Heavy Atoms | 30 |
| Complexity | 1084.4193 |
Chemical Identifiers
| CAS Number | 311333-07-0 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CSC1=C(C(=CC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)F)C#N |
Product Overview
A1168/0054367 (CAS 311333-07-0), with molecular formula C24H22FN3OS and molecular weight 419.15 g/mol. IUPAC: N-tert-butyl-2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridinyl]sulfanyl]acetamide.
Chemical Property Profile of A1168/0054367
Property Insights of A1168/0054367
The XLogP value of 5.43318 indicates that A1168/0054367 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for A1168/0054367. Following Lipinski's Rule of Five, A1168/0054367 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1168/0054367?
The CAS number of A1168/0054367 is 311333-07-0.
What is the molecular formula of A1168/0054367?
The molecular formula of A1168/0054367 is C24H22FN3OS.
What is the molecular weight of A1168/0054367?
The molecular weight of A1168/0054367 is 419.15 g/mol.
Where can I buy A1168/0054367?
You can request a quote for A1168/0054367 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1168/0054367?
Yes, KEHONG BIO provides custom synthesis services for A1168/0054367 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.