2-(4-Morpholinyl)benzothiazole
TL;DR: 2-(4-Morpholinyl)benzothiazole (CAS 4225-26-7) is a chemical compound with molecular formula C11H12N2OS and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,3-benzothiazol-2-yl)morpholine
Also Known As: 2-(4-Morpholinyl)benzothiazole, 2-MORPHOLINOBENZOTHIAZOLE, 2-(morpholin-4-yl)-1,3-benzothiazole, 4-(1,3-benzothiazol-2-yl)morpholine, 2-Morpholinobenzothiozole
| Molecular Formula | C11H12N2OS |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.06703 |
| Heavy Atoms | 15 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 4225-26-7 |
|---|---|
| SMILES | C1COCCN1C2=NC3=CC=CC=C3S2 |
| InChIKey | VVUVJGRVEYHIHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Morpholinyl)benzothiazole (CAS 4225-26-7), with molecular formula C11H12N2OS and molecular weight 220.07 g/mol. IUPAC: 4-(1,3-benzothiazol-2-yl)morpholine.
Chemical Property Profile of 2-(4-Morpholinyl)benzothiazole
Property Insights of 2-(4-Morpholinyl)benzothiazole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Morpholinyl)benzothiazole. With a topological polar surface area (TPSA) of 53.6 Ų, 2-(4-Morpholinyl)benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Morpholinyl)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-Morpholinyl)benzothiazole?
The CAS number of 2-(4-Morpholinyl)benzothiazole is 4225-26-7.
What is the molecular formula of 2-(4-Morpholinyl)benzothiazole?
The molecular formula of 2-(4-Morpholinyl)benzothiazole is C11H12N2OS.
What is the molecular weight of 2-(4-Morpholinyl)benzothiazole?
The molecular weight of 2-(4-Morpholinyl)benzothiazole is 220.07 g/mol.
Where can I buy 2-(4-Morpholinyl)benzothiazole?
You can request a quote for 2-(4-Morpholinyl)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-Morpholinyl)benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Morpholinyl)benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.