4-Bromo-2-morpholin-4-yl-1,3-benzothiazole
TL;DR: 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole (CAS 863000-90-2) is a chemical compound with molecular formula C11H11BrN2OS and molecular weight 297.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-bromo-1,3-benzothiazol-2-yl)morpholine
Also Known As: 4-bromo-2-morpholin-4-yl-1,3-benzothiazole, 4-bromo-2-(morpholin-4-yl)-1,3-benzothiazole, 4-(4-bromo-1,3-benzothiazol-2-yl)morpholine, 4-bromo-2-morpholino-1,3-benzothiazole, 4-(4-bromobenzo[d]thiazol-2-yl)morpholine
| Molecular Formula | C11H11BrN2OS |
|---|---|
| Molecular Weight | 297.98 g/mol |
| LogP | 2.8954 |
| Topological Polar Surface Area | 25.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.97754 |
| Heavy Atoms | 16 |
| Complexity | 507.6539 |
Chemical Identifiers
| CAS Number | 863000-90-2 |
|---|---|
| SMILES | C1COCCN1C2=NC3=C(S2)C=CC=C3Br |
Product Overview
4-Bromo-2-morpholin-4-yl-1,3-benzothiazole (CAS 863000-90-2), with molecular formula C11H11BrN2OS and molecular weight 297.98 g/mol. IUPAC: 4-(4-bromo-1,3-benzothiazol-2-yl)morpholine.
Chemical Property Profile of 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole
Property Insights of 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole
The XLogP value of 2.8954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole. With a topological polar surface area (TPSA) of 25.36 Ų, 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-morpholin-4-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 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole?
The CAS number of 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole is 863000-90-2.
What is the molecular formula of 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole?
The molecular formula of 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole is C11H11BrN2OS.
What is the molecular weight of 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole?
The molecular weight of 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole is 297.98 g/mol.
Where can I buy 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole?
You can request a quote for 4-Bromo-2-morpholin-4-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 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-morpholin-4-yl-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.