amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione structure](/static/products/7457/745786-88-3.webp)
3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione
TL;DR: 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione (CAS 745786-88-3) is a chemical compound with molecular formula C17H18N2OS2 and molecular weight 330.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(4-methoxyphenyl)methyl-methylamino]methyl]-1,3-benzothiazole-2-thione
Also Known As: 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione, 3-[[(4-methoxyphenyl)methyl-methyl-amino]methyl]benzothiazole-2-thione, 3-[[(4-methoxyphenyl)methyl-methylamino]methyl]-1,3-benzothiazole-2-thione
| Molecular Formula | C17H18N2OS2 |
|---|---|
| Molecular Weight | 330.09 g/mol |
| LogP | 4.53039 |
| Topological Polar Surface Area | 17.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.08606 |
| Heavy Atoms | 22 |
| Complexity | 820.54126 |
Chemical Identifiers
| CAS Number | 745786-88-3 |
|---|---|
| SMILES | CN(CC1=CC=C(C=C1)OC)CN2C3=CC=CC=C3SC2=S |
Product Overview
3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione (CAS 745786-88-3), with molecular formula C17H18N2OS2 and molecular weight 330.09 g/mol. IUPAC: 3-[[(4-methoxyphenyl)methyl-methylamino]methyl]-1,3-benzothiazole-2-thione.
Chemical Property Profile of 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione
Property Insights of 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione
The XLogP value of 4.53039 indicates that 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.4 Ų, 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione has 0 hydrogen bond donor(s) and 4 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 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione?
The CAS number of 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione is 745786-88-3.
What is the molecular formula of 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione?
The molecular formula of 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione is C17H18N2OS2.
What is the molecular weight of 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione?
The molecular weight of 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione is 330.09 g/mol.
Where can I buy 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione?
You can request a quote for 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-({[(4-methoxyphenyl)methyl](methyl)amino}methyl)-2,3-dihydro-1,3-benzothiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.