2,4-Dichloro-6-methylpyrimidine-5-carbonitrile
TL;DR: 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile (CAS 56035-64-4) is a chemical compound with molecular formula C6H3Cl2N3 and molecular weight 186.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-6-methylpyrimidine-5-carbonitrile
Also Known As: 2,4-dichloro-6-methylpyrimidine-5-carbonitrile, null, 2,4-Dichloro-6-methyl-pyrimidine-5-carbonitrile, 2,4-dichloro-6-methyl-5-Pyrimidinecarbonitrile, 5-cyano-2,4-dichloro-6-methyl-pyrimidine
| Molecular Formula | C6H3Cl2N3 |
|---|---|
| Molecular Weight | 186.97 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.9704 |
| Heavy Atoms | 11 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 56035-64-4 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)Cl)Cl)C#N |
| InChIKey | YQBPLKJZELWYDH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dichloro-6-methylpyrimidine-5-carbonitrile (CAS 56035-64-4), with molecular formula C6H3Cl2N3 and molecular weight 186.97 g/mol. IUPAC: 2,4-dichloro-6-methylpyrimidine-5-carbonitrile.
Chemical Property Profile of 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile
Property Insights of 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile. With a topological polar surface area (TPSA) of 49.6 Ų, 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile has 0 hydrogen bond donor(s) and 3 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 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile?
The CAS number of 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile is 56035-64-4.
What is the molecular formula of 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile?
The molecular formula of 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile is C6H3Cl2N3.
What is the molecular weight of 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile?
The molecular weight of 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile is 186.97 g/mol.
Where can I buy 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile?
You can request a quote for 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-6-methylpyrimidine-5-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.