![1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one structure](/static/products/879/879035-39-9.png)
1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one
TL;DR: 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one (CAS 879035-39-9) is a chemical compound with molecular formula C15H16N4O2S and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one
Also Known As: BAS 14051553, A4077/0173733, 1,3-dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one, 1,3-dimethyl-5-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}-1,3-dihydro-2H-benzimidazol-2-one, 1,3-dimethyl-5-{[(1-methyl-1H-imidazol-2-yl)thio]acetyl}-1,3-dihydro-2H-benzimidazol-2-one
| Molecular Formula | C15H16N4O2S |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 1.5855 |
| Topological Polar Surface Area | 61.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.0994 |
| Heavy Atoms | 22 |
| Complexity | 919.40546 |
Chemical Identifiers
| CAS Number | 879035-39-9 |
|---|---|
| SMILES | CN1C=CN=C1SCC(=O)C2=CC3=C(C=C2)N(C(=O)N3C)C |
Product Overview
1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one (CAS 879035-39-9), with molecular formula C15H16N4O2S and molecular weight 316.10 g/mol. IUPAC: 1,3-dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one.
Chemical Property Profile of 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one
Property Insights of 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one
The XLogP value of 1.5855 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one. The TPSA of 61.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one. Following Lipinski's Rule of Five, 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one 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 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one?
The CAS number of 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one is 879035-39-9.
What is the molecular formula of 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one?
The molecular formula of 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one is C15H16N4O2S.
What is the molecular weight of 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one?
The molecular weight of 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one is 316.10 g/mol.
Where can I buy 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one?
You can request a quote for 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl-5-[2-(1-methylimidazol-2-yl)sulfanylacetyl]benzimidazol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.