![4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole structure](/static/products/863/863000-94-6.png)
4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole
TL;DR: 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole (CAS 863000-94-6) is a chemical compound with molecular formula C16H13BrN2S and molecular weight 344.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-benzothiazole
Also Known As: AB00671001-01, F0647-0088, 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole, 2-(4-bromo-1,3-benzothiazol-2-yl)-1,2,3,4-tetrahydroisoquinoline, 4-bromo-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-benzothiazole
| Molecular Formula | C16H13BrN2S |
|---|---|
| Molecular Weight | 344.00 g/mol |
| LogP | 4.6215 |
| Topological Polar Surface Area | 16.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.9983 |
| Heavy Atoms | 20 |
| Complexity | 780.99786 |
Chemical Identifiers
| CAS Number | 863000-94-6 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C3=NC4=C(S3)C=CC=C4Br |
Product Overview
4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole (CAS 863000-94-6), with molecular formula C16H13BrN2S and molecular weight 344.00 g/mol. IUPAC: 4-bromo-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-benzothiazole.
Chemical Property Profile of 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole
Property Insights of 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole
The XLogP value of 4.6215 indicates that 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.13 Ų, 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole has 0 hydrogen bond donor(s) and 3 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-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole?
The CAS number of 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole is 863000-94-6.
What is the molecular formula of 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole?
The molecular formula of 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole is C16H13BrN2S.
What is the molecular weight of 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole?
The molecular weight of 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole is 344.00 g/mol.
Where can I buy 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole?
You can request a quote for 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole 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-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-2-(3,4-dihydroisoquinolin-2(1H)-yl)benzo[d]thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.