1-Bromo-2-chloro-4,6-difluorobenzene
TL;DR: 1-Bromo-2-chloro-4,6-difluorobenzene (CAS 10202-24-1) is a chemical compound with molecular formula C19H24ClN3OS2 and molecular weight 409.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[3-(6-chlorothieno[2,3-b][1,4]benzothiazin-4-yl)propyl]piperazin-1-yl]ethanol
Also Known As: 1-Bromo-2-chloro-4,6-difluorobenzene, 2-[4-[3-(6-chlorothieno[2,3-b][1,4]benzothiazin-4-yl)propyl]piperazin-1-yl]ethanol, 2-[4-[3-(6-chlorothieno[2,3-b][1,4]benzothiazin-4-yl)propyl], 2-{4-[3-(6-Chloro-4H-thieno[2,3-b][1,4]benzothiazin-4-yl)propyl]piperazin-1-yl}ethan-1-ol
| Molecular Formula | C19H24ClN3OS2 |
|---|---|
| Molecular Weight | 409.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.10492 |
| Heavy Atoms | 26 |
| Complexity | 453.0 |
Chemical Identifiers
| CAS Number | 10202-24-1 |
|---|---|
| SMILES | C1CN(CCN1CCCN2C3=C(SC=C3)SC4=C2C=C(C=C4)Cl)CCO |
| InChIKey | AIQZJGRZPNRVCO-UHFFFAOYSA-N |
Product Overview
1-Bromo-2-chloro-4,6-difluorobenzene (CAS 10202-24-1), with molecular formula C19H24ClN3OS2 and molecular weight 409.10 g/mol. IUPAC: 2-[4-[3-(6-chlorothieno[2,3-b][1,4]benzothiazin-4-yl)propyl]piperazin-1-yl]ethanol.
Chemical Property Profile of 1-Bromo-2-chloro-4,6-difluorobenzene
Property Insights of 1-Bromo-2-chloro-4,6-difluorobenzene
The XLogP value of 3.9 indicates that 1-Bromo-2-chloro-4,6-difluorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Bromo-2-chloro-4,6-difluorobenzene. Following Lipinski's Rule of Five, 1-Bromo-2-chloro-4,6-difluorobenzene has 1 hydrogen bond donor(s) and 6 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 1-Bromo-2-chloro-4,6-difluorobenzene?
The CAS number of 1-Bromo-2-chloro-4,6-difluorobenzene is 10202-24-1.
What is the molecular formula of 1-Bromo-2-chloro-4,6-difluorobenzene?
The molecular formula of 1-Bromo-2-chloro-4,6-difluorobenzene is C19H24ClN3OS2.
What is the molecular weight of 1-Bromo-2-chloro-4,6-difluorobenzene?
The molecular weight of 1-Bromo-2-chloro-4,6-difluorobenzene is 409.10 g/mol.
Where can I buy 1-Bromo-2-chloro-4,6-difluorobenzene?
You can request a quote for 1-Bromo-2-chloro-4,6-difluorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2-chloro-4,6-difluorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-chloro-4,6-difluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.