3-Chloro-5,6-dimethylpyridazine-4-carbonitrile
TL;DR: 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile (CAS 93824-72-7) is a chemical compound with molecular formula C7H6ClN3 and molecular weight 167.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-5,6-dimethylpyridazine-4-carbonitrile
Also Known As: 3-chloro-5,6-dimethylpyridazine-4-carbonitrile, 4-Pyridazinecarbonitrile, 3-chloro-5,6-dimethyl-, 3-chloro-5,6-dimethyl-pyridazine-4-carbonitrile, 824-515-2, RefChem:500060
| Molecular Formula | C7H6ClN3 |
|---|---|
| Molecular Weight | 167.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 49.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.02502 |
| Heavy Atoms | 11 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 93824-72-7 |
|---|---|
| SMILES | CC1=C(N=NC(=C1C#N)Cl)C |
| InChIKey | AOOOVEFJANVAOL-UHFFFAOYSA-N |
Product Overview
3-Chloro-5,6-dimethylpyridazine-4-carbonitrile (CAS 93824-72-7), with molecular formula C7H6ClN3 and molecular weight 167.03 g/mol. IUPAC: 3-chloro-5,6-dimethylpyridazine-4-carbonitrile.
Chemical Property Profile of 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile
Property Insights of 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile. With a topological polar surface area (TPSA) of 49.6 Ų, 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-5,6-dimethylpyridazine-4-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 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile?
The CAS number of 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile is 93824-72-7.
What is the molecular formula of 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile?
The molecular formula of 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile is C7H6ClN3.
What is the molecular weight of 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile?
The molecular weight of 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile is 167.03 g/mol.
Where can I buy 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile?
You can request a quote for 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-5,6-dimethylpyridazine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.