1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione
TL;DR: 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione (CAS 70529-85-0) is a chemical compound with molecular formula C7H10N2S and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3-prop-2-enylimidazole-2-thione
Also Known As: 1-allyl-3-methyl-1,3-dihydro-2H-imidazole-2-thione, 1-methyl-3-prop-2-enylimidazole-2-thione, 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione, 2H-imidazole-2-thione, 1,3-dihydro-1-methyl-3-(2-propenyl)-, RefChem:231734
| Molecular Formula | C7H10N2S |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 38.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.05647 |
| Heavy Atoms | 10 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 70529-85-0 |
|---|---|
| SMILES | CN1C=CN(C1=S)CC=C |
| InChIKey | DAELGZSZJLJMSN-UHFFFAOYSA-N |
Product Overview
1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione (CAS 70529-85-0), with molecular formula C7H10N2S and molecular weight 154.06 g/mol. IUPAC: 1-methyl-3-prop-2-enylimidazole-2-thione.
Chemical Property Profile of 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione
Property Insights of 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione. With a topological polar surface area (TPSA) of 38.6 Ų, 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione has 0 hydrogen bond donor(s) and 1 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-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione?
The CAS number of 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione is 70529-85-0.
What is the molecular formula of 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione?
The molecular formula of 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione is C7H10N2S.
What is the molecular weight of 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione?
The molecular weight of 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione is 154.06 g/mol.
Where can I buy 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione?
You can request a quote for 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-imidazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.