![3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one structure](/static/products/896/896691-31-9.png)
3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one
TL;DR: 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one (CAS 896691-31-9) is a chemical compound with molecular formula C24H21ClN2O3S and molecular weight 452.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6-chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one
Also Known As: 3-{10-chloro-7-thia-2,5-diazatricyclo[6.4.0.0?,?]dodeca-1(12),3,5,8,10-pentaen-4-yl}-6-hexyl-7-hydroxy-2H-chromen-2-one, F6782-3509, 3-(6-chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one, 3-(7-chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxy-2H-chromen-2-one, 3-{10-chloro-7-thia-2,5-diazatricyclo[6.4.0.0(2),]dodeca-1(12),3,5,8,10-pentaen-4-yl}-6-hexyl-7-hydroxy-2H-chromen-2-one
| Molecular Formula | C24H21ClN2O3S |
|---|---|
| Molecular Weight | 452.10 g/mol |
| LogP | 6.8042 |
| Topological Polar Surface Area | 67.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.09613 |
| Heavy Atoms | 31 |
| Complexity | 1481.5635 |
Chemical Identifiers
| CAS Number | 896691-31-9 |
|---|---|
| SMILES | CCCCCCC1=C(C=C2C(=C1)C=C(C(=O)O2)C3=CN4C5=C(C=C(C=C5)Cl)SC4=N3)O |
Product Overview
3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one (CAS 896691-31-9), with molecular formula C24H21ClN2O3S and molecular weight 452.10 g/mol. IUPAC: 3-(6-chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one.
Chemical Property Profile of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one
Property Insights of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one
The XLogP value of 6.8042 indicates that 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one. Following Lipinski's Rule of Five, 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one?
The CAS number of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one is 896691-31-9.
What is the molecular formula of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one?
The molecular formula of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one is C24H21ClN2O3S.
What is the molecular weight of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one?
The molecular weight of 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one is 452.10 g/mol.
Where can I buy 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one?
You can request a quote for 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(6-Chloroimidazo[2,1-b][1,3]benzothiazol-2-yl)-6-hexyl-7-hydroxychromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.