A0308/0014091
TL;DR: A0308/0014091 (CAS 327171-07-3) is a chemical compound with molecular formula C19H10BrF3N2OS2 and molecular weight 481.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile
Also Known As: A0308/0014091, 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile, 2-((2-(4-bromophenyl)-2-oxoethyl)thio)-6-(thiophen-2-yl)-4-(trifluoromethyl)nicotinonitrile, 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile, 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-thien-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile
| Molecular Formula | C19H10BrF3N2OS2 |
|---|---|
| Molecular Weight | 481.94 g/mol |
| LogP | 6.43808 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 481.937 |
| Heavy Atoms | 28 |
| Complexity | 1042.7761 |
Chemical Identifiers
| CAS Number | 327171-07-3 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)C3=CC=C(C=C3)Br |
Product Overview
A0308/0014091 (CAS 327171-07-3), with molecular formula C19H10BrF3N2OS2 and molecular weight 481.94 g/mol. IUPAC: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-thiophen-2-yl-4-(trifluoromethyl)pyridine-3-carbonitrile.
Chemical Property Profile of A0308/0014091
Property Insights of A0308/0014091
The XLogP value of 6.43808 indicates that A0308/0014091 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.75 Ų, A0308/0014091 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A0308/0014091 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A0308/0014091?
The CAS number of A0308/0014091 is 327171-07-3.
What is the molecular formula of A0308/0014091?
The molecular formula of A0308/0014091 is C19H10BrF3N2OS2.
What is the molecular weight of A0308/0014091?
The molecular weight of A0308/0014091 is 481.94 g/mol.
Where can I buy A0308/0014091?
You can request a quote for A0308/0014091 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A0308/0014091?
Yes, KEHONG BIO provides custom synthesis services for A0308/0014091 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.