Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride
TL;DR: Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride (CAS 29510-76-7) is a chemical compound with molecular formula C13H14Cl4N2 and molecular weight 337.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-(3,4-dichlorophenyl)-4-methyl-1-propan-2-ylimidazol-1-ium chloride
Also Known As: N3-pyridyl thiamine, N3PT, 2-Chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-imidazolium chloride, IMIDAZOLIUM, 2-CHLORO-3-(3,4-DICHLOROPHENYL)-1-ISOPROPYL-4-METHYL-, CHLORIDE, 2-Chloro-3-(3,4-dichlorophenyl)-4-methyl-1-propan-2-ylimidazol-1-iumchloride
| Molecular Formula | C13H14Cl4N2 |
|---|---|
| Molecular Weight | 337.99 g/mol |
| LogP | 1.62 |
| Topological Polar Surface Area | 8.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.98816 |
| Heavy Atoms | 19 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 29510-76-7 |
|---|---|
| SMILES | CC1=C[N+](=C(N1C2=CC(=C(C=C2)Cl)Cl)Cl)C(C)C.[Cl-] |
| InChIKey | KNWLGMKJURLZTQ-UHFFFAOYSA-M |
Product Overview
Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride (CAS 29510-76-7), with molecular formula C13H14Cl4N2 and molecular weight 337.99 g/mol. IUPAC: 2-chloro-3-(3,4-dichlorophenyl)-4-methyl-1-propan-2-ylimidazol-1-ium chloride.
Chemical Property Profile of Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride
Property Insights of Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride
The XLogP value of 1.62 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride. With a topological polar surface area (TPSA) of 8.8 Ų, Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride has 0 hydrogen bond donor(s) and 1 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 Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride?
The CAS number of Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride is 29510-76-7.
What is the molecular formula of Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride?
The molecular formula of Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride is C13H14Cl4N2.
What is the molecular weight of Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride?
The molecular weight of Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride is 337.99 g/mol.
Where can I buy Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride?
You can request a quote for Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Imidazolium, 2-chloro-3-(3,4-dichlorophenyl)-1-isopropyl-4-methyl-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.