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1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole
TL;DR: 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole (CAS 329061-91-8) is a chemical compound with molecular formula C21H20N4S and molecular weight 360.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole
Also Known As: AR-422/14021138, 1-benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole, Benzimidazole, 1-benzyl-2-(4,6-dimethyl-2-pyrimidylthiomethyl)-, 4,6-dimethyl-2-{[1-benzylbenzimidazol-2-yl]methylthio}pyrimidine, (1-Benzyl-1H-benzimidazol-2-yl)methyl 4,6-dimethyl-2-pyrimidinyl sulfide
| Molecular Formula | C21H20N4S |
|---|---|
| Molecular Weight | 360.14 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.14087 |
| Heavy Atoms | 26 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 329061-91-8 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SCC2=NC3=CC=CC=C3N2CC4=CC=CC=C4)C |
| InChIKey | WLJRPQRIYNSWSL-UHFFFAOYSA-N |
Product Overview
1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole (CAS 329061-91-8), with molecular formula C21H20N4S and molecular weight 360.14 g/mol. IUPAC: 1-benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole.
Chemical Property Profile of 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole
Property Insights of 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole
The XLogP value of 4.5 indicates that 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole. Following Lipinski's Rule of Five, 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole has 0 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 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole?
The CAS number of 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole is 329061-91-8.
What is the molecular formula of 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole?
The molecular formula of 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole is C21H20N4S.
What is the molecular weight of 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole?
The molecular weight of 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole is 360.14 g/mol.
Where can I buy 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole?
You can request a quote for 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.