6-(Dimethoxymethyl)-2-mercaptonicotinonitrile
TL;DR: 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile (CAS 175277-24-4) is a chemical compound with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(dimethoxymethyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile
Also Known As: 6-(dimethoxymethyl)-2-mercaptonicotinonitrile, Maybridge1_008683, 6-(Dimethoxymethyl)-2-thionicotinonitrile, 6-Dimethoxymethyl-2-mercapto-nicotinonitrile, 6-(dimethoxymethyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile
| Molecular Formula | C9H10N2O2S |
|---|---|
| Molecular Weight | 210.05 g/mol |
| LogP | 1.90727 |
| Topological Polar Surface Area | 58.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.0463 |
| Heavy Atoms | 14 |
| Complexity | 404.00836 |
Chemical Identifiers
| CAS Number | 175277-24-4 |
|---|---|
| SMILES | COC(C1=CC=C(C(=S)N1)C#N)OC |
Product Overview
6-(Dimethoxymethyl)-2-mercaptonicotinonitrile (CAS 175277-24-4), with molecular formula C9H10N2O2S and molecular weight 210.05 g/mol. IUPAC: 6-(dimethoxymethyl)-2-sulfanylidene-1H-pyridine-3-carbonitrile.
Chemical Property Profile of 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile
Property Insights of 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile
The XLogP value of 1.90727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile. With a topological polar surface area (TPSA) of 58.04 Ų, 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile 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 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile?
The CAS number of 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile is 175277-24-4.
What is the molecular formula of 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile?
The molecular formula of 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile is C9H10N2O2S.
What is the molecular weight of 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile?
The molecular weight of 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile is 210.05 g/mol.
Where can I buy 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile?
You can request a quote for 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(Dimethoxymethyl)-2-mercaptonicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.