![3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- structure](/static/products/112/112955-01-8.png)
3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-
TL;DR: 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- (CAS 112955-01-8) is a chemical compound with molecular formula C14H13N3S and molecular weight 255.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminophenyl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile
Also Known As: 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-, 2-(4-aminophenyl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile, 2-[(4-aminophenyl)sulfanyl]-4,6-dimethylnicotinonitrile, AO-799/43263515, 3-Pyridinecarbonitrile,2-[(4-aminophenyl)thio]-4,6-dimethyl
| Molecular Formula | C14H13N3S |
|---|---|
| Molecular Weight | 255.08 g/mol |
| LogP | 3.30352 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 255.08302 |
| Heavy Atoms | 18 |
| Complexity | 612.17163 |
Chemical Identifiers
| CAS Number | 112955-01-8 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)SC2=CC=C(C=C2)N)C |
Product Overview
3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- (CAS 112955-01-8), with molecular formula C14H13N3S and molecular weight 255.08 g/mol. IUPAC: 2-(4-aminophenyl)sulfanyl-4,6-dimethylpyridine-3-carbonitrile.
Chemical Property Profile of 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-
Property Insights of 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-
The XLogP value of 3.30352 indicates that 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- 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-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-. Following Lipinski's Rule of Five, 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- 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-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-?
The CAS number of 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- is 112955-01-8.
What is the molecular formula of 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-?
The molecular formula of 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- is C14H13N3S.
What is the molecular weight of 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-?
The molecular weight of 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- is 255.08 g/mol.
Where can I buy 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-?
You can request a quote for 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyridinecarbonitrile, 2-[(4-aminophenyl)thio]-4,6-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.