![1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol structure](/static/products/3392/339276-66-3.webp)
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol
TL;DR: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol (CAS 339276-66-3) is a chemical compound with molecular formula C9H5ClF3N3S and molecular weight 278.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thione
Also Known As: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-imidazole-2-thiol, 3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-imidazole-2-thione, 3-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-1H-imidazole-2-thione, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2,3-dihydro-1H-imidazole-2-thione
| Molecular Formula | C9H5ClF3N3S |
|---|---|
| Molecular Weight | 278.98 g/mol |
| LogP | 3.60209 |
| Topological Polar Surface Area | 33.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.98447 |
| Heavy Atoms | 17 |
| Complexity | 602.0189 |
Chemical Identifiers
| CAS Number | 339276-66-3 |
|---|---|
| SMILES | C1=CN(C(=S)N1)C2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol (CAS 339276-66-3), with molecular formula C9H5ClF3N3S and molecular weight 278.98 g/mol. IUPAC: 3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thione.
Chemical Property Profile of 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol
Property Insights of 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol
The XLogP value of 3.60209 indicates that 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.61 Ų, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol has 1 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 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol?
The CAS number of 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol is 339276-66-3.
What is the molecular formula of 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol?
The molecular formula of 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol is C9H5ClF3N3S.
What is the molecular weight of 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol?
The molecular weight of 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol is 278.98 g/mol.
Where can I buy 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol?
You can request a quote for 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-imidazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.