1-Bromophenoxathiin-10,10-dioxide
TL;DR: 1-Bromophenoxathiin-10,10-dioxide (CAS 207300-59-2) is a chemical compound with molecular formula C12H7BrO3S and molecular weight 309.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromophenoxathiine 10,10-dioxide
Also Known As: 1-Bromophenoxathiin-10,10-dioxide, 1-bromophenoxathiine 10,10-dioxide, Phenoxathiin, 1-bromo-, 10,10-dioxide, 1-Bromo-phenoxathiine 10,10-dioxide
| Molecular Formula | C12H7BrO3S |
|---|---|
| Molecular Weight | 309.93 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 309.92993 |
| Heavy Atoms | 17 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 207300-59-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)OC3=C(S2(=O)=O)C(=CC=C3)Br |
| InChIKey | AQQYAUYICONMJU-UHFFFAOYSA-N |
Product Overview
1-Bromophenoxathiin-10,10-dioxide (CAS 207300-59-2), with molecular formula C12H7BrO3S and molecular weight 309.93 g/mol. IUPAC: 1-bromophenoxathiine 10,10-dioxide.
Chemical Property Profile of 1-Bromophenoxathiin-10,10-dioxide
Property Insights of 1-Bromophenoxathiin-10,10-dioxide
The XLogP value of 3.0 indicates that 1-Bromophenoxathiin-10,10-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 1-Bromophenoxathiin-10,10-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromophenoxathiin-10,10-dioxide 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 1-Bromophenoxathiin-10,10-dioxide?
The CAS number of 1-Bromophenoxathiin-10,10-dioxide is 207300-59-2.
What is the molecular formula of 1-Bromophenoxathiin-10,10-dioxide?
The molecular formula of 1-Bromophenoxathiin-10,10-dioxide is C12H7BrO3S.
What is the molecular weight of 1-Bromophenoxathiin-10,10-dioxide?
The molecular weight of 1-Bromophenoxathiin-10,10-dioxide is 309.93 g/mol.
Where can I buy 1-Bromophenoxathiin-10,10-dioxide?
You can request a quote for 1-Bromophenoxathiin-10,10-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromophenoxathiin-10,10-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromophenoxathiin-10,10-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.