1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride
TL;DR: 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride (CAS 57359-17-8) is a chemical compound with molecular formula C16H20ClN3OS and molecular weight 337.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1,3-thiazole;hydrochloride
Also Known As: s3608, 1-[methyl]-4-thiazol-2-ylpiperaziniumchloride, 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride, 1-(Coumaran-5-ylmethyl)-4-(2-thiazolyl)piperazine, 2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1,3-thiazole;hydrochloride
| Molecular Formula | C16H20ClN3OS |
|---|---|
| Molecular Weight | 337.10 g/mol |
| LogP | 2.822 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.10156 |
| Heavy Atoms | 22 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 57359-17-8 |
|---|---|
| SMILES | C1COC2=C1C=C(C=C2)CN3CCN(CC3)C4=NC=CS4.Cl |
| InChIKey | ZPWJKCKRQHIQNM-UHFFFAOYSA-N |
Product Overview
1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride (CAS 57359-17-8), with molecular formula C16H20ClN3OS and molecular weight 337.10 g/mol. IUPAC: 2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-1,3-thiazole;hydrochloride.
Chemical Property Profile of 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride
Property Insights of 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride
The XLogP value of 2.822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride. With a topological polar surface area (TPSA) of 56.8 Ų, 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride 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-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride?
The CAS number of 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride is 57359-17-8.
What is the molecular formula of 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride?
The molecular formula of 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride is C16H20ClN3OS.
What is the molecular weight of 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride?
The molecular weight of 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride is 337.10 g/mol.
Where can I buy 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride?
You can request a quote for 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-((2,3-Dihydro-5-benzofuranyl)methyl)-4-thiazol-2-ylpiperazinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.