3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile
TL;DR: 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile (CAS 54632-08-5) is a chemical compound with molecular formula C6H5ClN4 and molecular weight 168.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-5-chloro-6-methylpyrazine-2-carbonitrile
Also Known As: 3-amino-5-chloro-6-methylpyrazine-2-carbonitrile, 3-amino-5-chloro-6-methyl-2-pyrazinecarbonitrile, 2-Pyrazinecarbonitrile, 3-amino-5-chloro-6-methyl-, Pyrazinecarbonitrile, 3-amino-5-chloro-6-methyl-, 3-AMINO-5-CHLORO-6-METHYLPYRAZINECARBONITRILE
| Molecular Formula | C6H5ClN4 |
|---|---|
| Molecular Weight | 168.02 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.02028 |
| Heavy Atoms | 11 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 54632-08-5 |
|---|---|
| SMILES | CC1=C(N=C(C(=N1)C#N)N)Cl |
| InChIKey | NDADGNJBYZIATE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile (CAS 54632-08-5), with molecular formula C6H5ClN4 and molecular weight 168.02 g/mol. IUPAC: 3-amino-5-chloro-6-methylpyrazine-2-carbonitrile.
Chemical Property Profile of 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile
Property Insights of 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile. Following Lipinski's Rule of Five, 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile 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-Amino-5-chloro-6-methylpyrazine-2-carbonitrile?
The CAS number of 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile is 54632-08-5.
What is the molecular formula of 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile?
The molecular formula of 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile is C6H5ClN4.
What is the molecular weight of 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile?
The molecular weight of 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile is 168.02 g/mol.
Where can I buy 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile?
You can request a quote for 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-5-chloro-6-methylpyrazine-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.