A0007/0000299
TL;DR: A0007/0000299 (CAS 313647-27-7) is a chemical compound with molecular formula C26H17BrFN3OS and molecular weight 517.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridinyl]sulfanyl]acetamide
Also Known As: A0007/0000299, N-(4-bromophenyl)-2-[3-cyano-4-(3-fluorophenyl)-6-phenylpyridin-2-yl]sulfanylacetamide, N-(4-bromophenyl)-2-{[3-cyano-4-(3-fluorophenyl)-6-phenylpyridin-2-yl]sulfanyl}acetamide, N-(4-bromophenyl)-2-((3-cyano-4-(3-fluorophenyl)-6-phenylpyridin-2-yl)thio)acetamide, N-(4-Bromophenyl)-2-{[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridinyl]thio}acetamide
| Molecular Formula | C26H17BrFN3OS |
|---|---|
| Molecular Weight | 517.03 g/mol |
| LogP | 6.91968 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 517.02594 |
| Heavy Atoms | 33 |
| Complexity | 1338.2458 |
Chemical Identifiers
| CAS Number | 313647-27-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC(=CC=C3)F)C#N)SCC(=O)NC4=CC=C(C=C4)Br |
Product Overview
A0007/0000299 (CAS 313647-27-7), with molecular formula C26H17BrFN3OS and molecular weight 517.03 g/mol. IUPAC: N-(4-bromophenyl)-2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridinyl]sulfanyl]acetamide.
Chemical Property Profile of A0007/0000299
Property Insights of A0007/0000299
The XLogP value of 6.91968 indicates that A0007/0000299 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 A0007/0000299. Following Lipinski's Rule of Five, A0007/0000299 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 A0007/0000299?
The CAS number of A0007/0000299 is 313647-27-7.
What is the molecular formula of A0007/0000299?
The molecular formula of A0007/0000299 is C26H17BrFN3OS.
What is the molecular weight of A0007/0000299?
The molecular weight of A0007/0000299 is 517.03 g/mol.
Where can I buy A0007/0000299?
You can request a quote for A0007/0000299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0007/0000299?
Yes, KEHONG BIO provides custom synthesis services for A0007/0000299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.