![1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone structure](/static/products/929/929965-33-3.png)
1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
TL;DR: 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone (CAS 929965-33-3) is a chemical compound with molecular formula C19H22N4O2S and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Also Known As: 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone, 1-(1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl)-2-((5-phenyl-4H-1,2,4-triazol-3-yl)thio)ethanone, 1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone
| Molecular Formula | C19H22N4O2S |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 3.51144 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 370.14636 |
| Heavy Atoms | 26 |
| Complexity | 886.3386 |
Chemical Identifiers
| CAS Number | 929965-33-3 |
|---|---|
| SMILES | CC1=CC(=C(N1CCOC)C)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3 |
Product Overview
1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone (CAS 929965-33-3), with molecular formula C19H22N4O2S and molecular weight 370.15 g/mol. IUPAC: 1-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone.
Chemical Property Profile of 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Property Insights of 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
The XLogP value of 3.51144 indicates that 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone. Following Lipinski's Rule of Five, 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone has 1 hydrogen bond donor(s) and 5 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-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone?
The CAS number of 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone is 929965-33-3.
What is the molecular formula of 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone?
The molecular formula of 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone is C19H22N4O2S.
What is the molecular weight of 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone?
The molecular weight of 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone is 370.15 g/mol.
Where can I buy 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone?
You can request a quote for 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.