1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-
TL;DR: 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- (CAS 501656-23-1) is a chemical compound with molecular formula C10H9N5S and molecular weight 231.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-methylsulfanyl-1-pyridin-2-ylpyrazole-4-carbonitrile
Also Known As: 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-, 3-Amino-5-(methylsulfanyl)-1-(2-pyridinyl)-1H-pyrazole-4-car, 3-amino-5-methylsulfanyl-1-pyridin-2-ylpyrazole-4-carbonitrile
| Molecular Formula | C10H9N5S |
|---|---|
| Molecular Weight | 231.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.05786 |
| Heavy Atoms | 16 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 501656-23-1 |
|---|---|
| SMILES | CSC1=C(C(=NN1C2=CC=CC=N2)N)C#N |
| InChIKey | BTGFEBDQMWBRSL-UHFFFAOYSA-N |
Product Overview
1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- (CAS 501656-23-1), with molecular formula C10H9N5S and molecular weight 231.06 g/mol. IUPAC: 3-amino-5-methylsulfanyl-1-pyridin-2-ylpyrazole-4-carbonitrile.
Chemical Property Profile of 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-
Property Insights of 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-. Following Lipinski's Rule of Five, 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- has 1 hydrogen bond donor(s) and 5 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 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-?
The CAS number of 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- is 501656-23-1.
What is the molecular formula of 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-?
The molecular formula of 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- is C10H9N5S.
What is the molecular weight of 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-?
The molecular weight of 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- is 231.06 g/mol.
Where can I buy 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-?
You can request a quote for 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole-4-carbonitrile, 3-amino-5-(methylthio)-1-(2-pyridinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.