5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide
TL;DR: 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide (CAS 351005-12-4) is a chemical compound with molecular formula C8H7BrO2S and molecular weight 245.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1,3-dihydro-2-benzothiophene 2,2-dioxide
Also Known As: 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide, 5-Bromo-1,3-dihydrobenzo[c]thiophene 2,2-dioxide, 5-bromo-1,3-dihydro-2, 5-bromo-1,3-dihydro-2-benzothiophene 2,2-dioxide, Benzo[c]thiophene, 5-bromo-1,3-dihydro-, 2,2-dioxide
| Molecular Formula | C8H7BrO2S |
|---|---|
| Molecular Weight | 245.94 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 245.93501 |
| Heavy Atoms | 12 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 351005-12-4 |
|---|---|
| SMILES | C1C2=C(CS1(=O)=O)C=C(C=C2)Br |
| InChIKey | QRJKMGQWHAQEST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide (CAS 351005-12-4), with molecular formula C8H7BrO2S and molecular weight 245.94 g/mol. IUPAC: 5-bromo-1,3-dihydro-2-benzothiophene 2,2-dioxide.
Chemical Property Profile of 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide
Property Insights of 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide. With a topological polar surface area (TPSA) of 42.5 Ų, 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide has 0 hydrogen bond donor(s) and 2 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 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide?
The CAS number of 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide is 351005-12-4.
What is the molecular formula of 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide?
The molecular formula of 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide is C8H7BrO2S.
What is the molecular weight of 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide?
The molecular weight of 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide is 245.94 g/mol.
Where can I buy 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide?
You can request a quote for 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-1,3-dihydro-benzo(c)thiophene 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.