![2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole structure](/static/products/4780/478076-97-0.webp)
2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole
TL;DR: 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole (CAS 478076-97-0) is a chemical compound with molecular formula C18H17Cl2N3S and molecular weight 377.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-1,3-benzothiazole
Also Known As: Bionet1_003739, 7P-333S, 2-[4-(3,4-dichlorobenzyl)piperazino]-1,3-benzothiazole, 2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-1,3-benzothiazole, 2-{4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl}-1,3-benzothiazole
| Molecular Formula | C18H17Cl2N3S |
|---|---|
| Molecular Weight | 377.05 g/mol |
| LogP | 4.9253 |
| Topological Polar Surface Area | 19.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.05203 |
| Heavy Atoms | 24 |
| Complexity | 823.34607 |
Chemical Identifiers
| CAS Number | 478076-97-0 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC(=C(C=C2)Cl)Cl)C3=NC4=CC=CC=C4S3 |
Product Overview
2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole (CAS 478076-97-0), with molecular formula C18H17Cl2N3S and molecular weight 377.05 g/mol. IUPAC: 2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-1,3-benzothiazole.
Chemical Property Profile of 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole
Property Insights of 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole
The XLogP value of 4.9253 indicates that 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.37 Ų, 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole 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 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole?
The CAS number of 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole is 478076-97-0.
What is the molecular formula of 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole?
The molecular formula of 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole is C18H17Cl2N3S.
What is the molecular weight of 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole?
The molecular weight of 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole is 377.05 g/mol.
Where can I buy 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole?
You can request a quote for 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(3,4-Dichlorobenzyl)piperazino]-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.