1-methyl-1H-imidazole-5-sulfonyl chloride
TL;DR: 1-methyl-1H-imidazole-5-sulfonyl chloride (CAS 479552-18-6) is a chemical compound with molecular formula C4H5ClN2O2S and molecular weight 179.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylimidazole-4-sulfonyl chloride
Also Known As: 1-Methyl-1H-imidazole-5-sulfonyl chloride, 3-methylimidazole-4-sulfonyl Chloride, 1H-Imidazole-5-sulfonyl chloride, 1-methyl-, 1-methylimidazole-5-sulfonyl chloride, 3-methyl-3H-imidazole-4-sulfonyl chloride
| Molecular Formula | C4H5ClN2O2S |
|---|---|
| Molecular Weight | 179.98 g/mol |
| LogP | 0.3476 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.97603 |
| Heavy Atoms | 10 |
| Complexity | 328.7817 |
Chemical Identifiers
| CAS Number | 479552-18-6 |
|---|---|
| SMILES | CN1C=NC=C1S(=O)(=O)Cl |
Product Overview
1-methyl-1H-imidazole-5-sulfonyl chloride (CAS 479552-18-6), with molecular formula C4H5ClN2O2S and molecular weight 179.98 g/mol. IUPAC: 3-methylimidazole-4-sulfonyl chloride.
Chemical Property Profile of 1-methyl-1H-imidazole-5-sulfonyl chloride
Property Insights of 1-methyl-1H-imidazole-5-sulfonyl chloride
The XLogP value of 0.3476 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-1H-imidazole-5-sulfonyl chloride. With a topological polar surface area (TPSA) of 51.96 Ų, 1-methyl-1H-imidazole-5-sulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-1H-imidazole-5-sulfonyl chloride has 0 hydrogen bond donor(s) and 3 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-methyl-1H-imidazole-5-sulfonyl chloride?
The CAS number of 1-methyl-1H-imidazole-5-sulfonyl chloride is 479552-18-6.
What is the molecular formula of 1-methyl-1H-imidazole-5-sulfonyl chloride?
The molecular formula of 1-methyl-1H-imidazole-5-sulfonyl chloride is C4H5ClN2O2S.
What is the molecular weight of 1-methyl-1H-imidazole-5-sulfonyl chloride?
The molecular weight of 1-methyl-1H-imidazole-5-sulfonyl chloride is 179.98 g/mol.
Where can I buy 1-methyl-1H-imidazole-5-sulfonyl chloride?
You can request a quote for 1-methyl-1H-imidazole-5-sulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-1H-imidazole-5-sulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-1H-imidazole-5-sulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.