2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole
TL;DR: 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole (CAS 309279-65-0) is a chemical compound with molecular formula C18H17N3OS and molecular weight 323.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-phenylmethanone
Also Known As: 2-(4-benzoylpiperazin-1-yl)-1,3-benzothiazole, 7P-354S, (4-(benzo[d]thiazol-2-yl)piperazin-1-yl)(phenyl)methanone, [4-(1,3-benzothiazol-2-yl)piperazino](phenyl)methanone, [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-phenylmethanone
| Molecular Formula | C18H17N3OS |
|---|---|
| Molecular Weight | 323.11 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 64.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.10922 |
| Heavy Atoms | 23 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 309279-65-0 |
|---|---|
| SMILES | C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)C4=CC=CC=C4 |
| InChIKey | AZFGGVGYUUFNQP-UHFFFAOYSA-N |
Product Overview
2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole (CAS 309279-65-0), with molecular formula C18H17N3OS and molecular weight 323.11 g/mol. IUPAC: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-phenylmethanone.
Chemical Property Profile of 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole
Property Insights of 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole
The XLogP value of 3.8 indicates that 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole. Following Lipinski's Rule of Five, 2-(4-Benzoylpiperazin-1-yl)-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-Benzoylpiperazin-1-yl)-1,3-benzothiazole?
The CAS number of 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole is 309279-65-0.
What is the molecular formula of 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole?
The molecular formula of 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole is C18H17N3OS.
What is the molecular weight of 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole?
The molecular weight of 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole is 323.11 g/mol.
Where can I buy 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole?
You can request a quote for 2-(4-Benzoylpiperazin-1-yl)-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-Benzoylpiperazin-1-yl)-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Benzoylpiperazin-1-yl)-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.