![3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile structure](/static/products/3383/338396-88-6.webp)
3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile
TL;DR: 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile (CAS 338396-88-6) is a chemical compound with molecular formula C13H8F3N3S and molecular weight 295.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-aminophenyl)sulfanyl-5-(trifluoromethyl)pyridine-2-carbonitrile
Also Known As: 3-[(2-aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile, 3-[(2-aminophenyl)sulfanyl]-5-(trifluoromethyl)pyridine-2-carbonitrile, 3-(2-aminophenyl)sulfanyl-5-(trifluoromethyl)pyridine-2-carbonitrile, 3-(2-Aminophenyl)sulfanyl-5-(trifluoromethyl)-2-pyridinecarbonitrile
| Molecular Formula | C13H8F3N3S |
|---|---|
| Molecular Weight | 295.04 g/mol |
| LogP | 3.70548 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.0391 |
| Heavy Atoms | 20 |
| Complexity | 677.2921 |
Chemical Identifiers
| CAS Number | 338396-88-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)SC2=C(N=CC(=C2)C(F)(F)F)C#N |
Product Overview
3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile (CAS 338396-88-6), with molecular formula C13H8F3N3S and molecular weight 295.04 g/mol. IUPAC: 3-(2-aminophenyl)sulfanyl-5-(trifluoromethyl)pyridine-2-carbonitrile.
Chemical Property Profile of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile
Property Insights of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile
The XLogP value of 3.70548 indicates that 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile. Following Lipinski's Rule of Five, 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile?
The CAS number of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile is 338396-88-6.
What is the molecular formula of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile?
The molecular formula of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile is C13H8F3N3S.
What is the molecular weight of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile?
The molecular weight of 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile is 295.04 g/mol.
Where can I buy 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile?
You can request a quote for 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-Aminophenyl)sulfanyl]-5-(trifluoromethyl)-2-pyridinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.