![3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione structure](/static/products/3614/361464-36-0.webp)
3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione
TL;DR: 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione (CAS 361464-36-0) is a chemical compound with molecular formula C27H29N3OS2 and molecular weight 475.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-benzhydrylpiperazin-1-yl)methyl]-6-ethoxy-1,3-benzothiazole-2-thione
Also Known As: A2393/0101333, 3-{[4-(diphenylmethyl)piperazin-1-yl]methyl}-6-ethoxy-1,3-benzothiazole-2(3H)-thione, 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione, 3-((4-(Diphenylmethyl)-1-piperazinyl)methyl)-6-ethoxy-2(3H)-benzothiazolethione, 3-[(4-benzhydrylpiperazin-1-yl)methyl]-6-ethoxy-1,3-benzothiazole-2-thione
| Molecular Formula | C27H29N3OS2 |
|---|---|
| Molecular Weight | 475.18 g/mol |
| LogP | 6.19569 |
| Topological Polar Surface Area | 20.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 475.1752 |
| Heavy Atoms | 33 |
| Complexity | 1205.3529 |
Chemical Identifiers
| CAS Number | 361464-36-0 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N(C(=S)S2)CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione (CAS 361464-36-0), with molecular formula C27H29N3OS2 and molecular weight 475.18 g/mol. IUPAC: 3-[(4-benzhydrylpiperazin-1-yl)methyl]-6-ethoxy-1,3-benzothiazole-2-thione.
Chemical Property Profile of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione
Property Insights of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione
The XLogP value of 6.19569 indicates that 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.64 Ų, 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione?
The CAS number of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione is 361464-36-0.
What is the molecular formula of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione?
The molecular formula of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione is C27H29N3OS2.
What is the molecular weight of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione?
The molecular weight of 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione is 475.18 g/mol.
Where can I buy 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione?
You can request a quote for 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione?
Yes, KEHONG BIO provides custom synthesis services for 3-[[4-(Diphenylmethyl)-1-piperazinyl]methyl]-6-ethoxy-2(3H)-benzothiazolethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.