4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione
TL;DR: 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione (CAS 107127-24-2) is a chemical compound with molecular formula C6H8N2OS and molecular weight 156.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-2-sulfanylideneimidazole-4-carbaldehyde
Also Known As: 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione, 1,3-dimethyl-2-sulfanylideneimidazole-4-carbaldehyde, 4-Formyl-1,3-dihydro-1,3-dimethyl-2H-imidazole-2-thione, 1,3-Dimethyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carbaldehyde, 1,3-Dimethyl-2-thioxo-2,3-dihydro-1H-imidazole-4-carbaldehyde #
| Molecular Formula | C6H8N2OS |
|---|---|
| Molecular Weight | 156.04 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.03574 |
| Heavy Atoms | 10 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 107127-24-2 |
|---|---|
| SMILES | CN1C=C(N(C1=S)C)C=O |
| InChIKey | SGBRFVMVOMQSDL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione (CAS 107127-24-2), with molecular formula C6H8N2OS and molecular weight 156.04 g/mol. IUPAC: 1,3-dimethyl-2-sulfanylideneimidazole-4-carbaldehyde.
Chemical Property Profile of 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione
Property Insights of 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione
The XLogP value of -0.2 indicates that 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.6 Ų, 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione has 0 hydrogen bond donor(s) and 2 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 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione?
The CAS number of 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione is 107127-24-2.
What is the molecular formula of 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione?
The molecular formula of 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione is C6H8N2OS.
What is the molecular weight of 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione?
The molecular weight of 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione is 156.04 g/mol.
Where can I buy 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione?
You can request a quote for 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-Formyl-1,3-dimethyl-1,3(2H)-dihydroimidazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.