2-brom-3,4-dimethylpyridin
TL;DR: 2-brom-3,4-dimethylpyridin (CAS 332045-88-2) is a chemical compound with molecular formula C22H20ClN3O2S and molecular weight 425.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxamide
Also Known As: 2-brom-3,4-dimethylpyridin, BAS 00865592, AB00088603-01, 4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-(methylsulfanyl)-1,4-dihydropyridine-3-carboxamide, 4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C22H20ClN3O2S |
|---|---|
| Molecular Weight | 425.10 g/mol |
| LogP | 5.04628 |
| Topological Polar Surface Area | 74.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.09647 |
| Heavy Atoms | 29 |
| Complexity | 1056.0181 |
Chemical Identifiers
| CAS Number | 332045-88-2 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SC)C#N)C2=CC=CC=C2Cl)C(=O)NC3=CC=CC=C3OC |
Product Overview
2-brom-3,4-dimethylpyridin (CAS 332045-88-2), with molecular formula C22H20ClN3O2S and molecular weight 425.10 g/mol. IUPAC: 4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxamide.
Chemical Property Profile of 2-brom-3,4-dimethylpyridin
Property Insights of 2-brom-3,4-dimethylpyridin
The XLogP value of 5.04628 indicates that 2-brom-3,4-dimethylpyridin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.15 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-brom-3,4-dimethylpyridin. Following Lipinski's Rule of Five, 2-brom-3,4-dimethylpyridin has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-brom-3,4-dimethylpyridin?
The CAS number of 2-brom-3,4-dimethylpyridin is 332045-88-2.
What is the molecular formula of 2-brom-3,4-dimethylpyridin?
The molecular formula of 2-brom-3,4-dimethylpyridin is C22H20ClN3O2S.
What is the molecular weight of 2-brom-3,4-dimethylpyridin?
The molecular weight of 2-brom-3,4-dimethylpyridin is 425.10 g/mol.
Where can I buy 2-brom-3,4-dimethylpyridin?
You can request a quote for 2-brom-3,4-dimethylpyridin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-brom-3,4-dimethylpyridin?
Yes, KEHONG BIO provides custom synthesis services for 2-brom-3,4-dimethylpyridin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.