![Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate structure](/static/products/941/941935-92-8.png)
Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate
TL;DR: Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate (CAS 941935-92-8) is a chemical compound with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-methyl 4-O-[2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-6-yl] benzene-1,4-dicarboxylate
Also Known As: F2607-0318, 1-methyl 4-[2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-6-yl] benzene-1,4-dicarboxylate, methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate, 1-O-methyl 4-O-[2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-6-yl] benzene-1,4-dicarboxylate, [2-(4-methylpiperazin-1-yl)benzothiazol-6-yl] Methyl Benzene-1,4-dicarboxylate
| Molecular Formula | C21H21N3O4S |
|---|---|
| Molecular Weight | 411.13 g/mol |
| LogP | 3.0539 |
| Topological Polar Surface Area | 71.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.12527 |
| Heavy Atoms | 29 |
| Complexity | 1039.7657 |
Chemical Identifiers
| CAS Number | 941935-92-8 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)C(=O)OC |
Product Overview
Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate (CAS 941935-92-8), with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol. IUPAC: 1-O-methyl 4-O-[2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-6-yl] benzene-1,4-dicarboxylate.
Chemical Property Profile of Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate
Property Insights of Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate
The XLogP value of 3.0539 indicates that Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate. Following Lipinski's Rule of Five, Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate has 0 hydrogen bond donor(s) and 8 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 Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate?
The CAS number of Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate is 941935-92-8.
What is the molecular formula of Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate?
The molecular formula of Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate is C21H21N3O4S.
What is the molecular weight of Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate?
The molecular weight of Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate is 411.13 g/mol.
Where can I buy Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate?
You can request a quote for Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (2-(4-methylpiperazin-1-yl)benzo[d]thiazol-6-yl) terephthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.