2-(Piperazin-1-ylmethyl)-1,3-benzothiazole
TL;DR: 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole (CAS 232263-03-5) is a chemical compound with molecular formula C12H15N3S and molecular weight 233.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(piperazin-1-ylmethyl)-1,3-benzothiazole
Also Known As: 2-(piperazin-1-ylmethyl)-1,3-benzothiazole, 2-(piperazin-1-ylmethyl)benzo[d]thiazole, 2-(piperazinylmethyl)benzothiazole, 2-[(piperazin-1-yl)methyl]-1,3-benzothiazole, 2-(piperazin-1-ylmethyl)benzothiazole
| Molecular Formula | C12H15N3S |
|---|---|
| Molecular Weight | 233.10 g/mol |
| LogP | 1.7015 |
| Topological Polar Surface Area | 28.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.09866 |
| Heavy Atoms | 16 |
| Complexity | 440.82355 |
Chemical Identifiers
| CAS Number | 232263-03-5 |
|---|---|
| SMILES | C1CN(CCN1)CC2=NC3=CC=CC=C3S2 |
Product Overview
2-(Piperazin-1-ylmethyl)-1,3-benzothiazole (CAS 232263-03-5), with molecular formula C12H15N3S and molecular weight 233.10 g/mol. IUPAC: 2-(piperazin-1-ylmethyl)-1,3-benzothiazole.
Chemical Property Profile of 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole
Property Insights of 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole
The XLogP value of 1.7015 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole. With a topological polar surface area (TPSA) of 28.16 Ų, 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole has 1 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-(Piperazin-1-ylmethyl)-1,3-benzothiazole?
The CAS number of 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole is 232263-03-5.
What is the molecular formula of 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole?
The molecular formula of 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole is C12H15N3S.
What is the molecular weight of 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole?
The molecular weight of 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole is 233.10 g/mol.
Where can I buy 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole?
You can request a quote for 2-(Piperazin-1-ylmethyl)-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-(Piperazin-1-ylmethyl)-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(Piperazin-1-ylmethyl)-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.