三溴甲基苯基砜
TL;DR: 三溴甲基苯基砜 (CAS 17025-47-7) is a chemical compound with molecular formula C7H5Br3O2S and molecular weight 389.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三溴甲基苯基砜
tribromomethylsulfonylbenzene
Also Known As: Tribromomethyl phenyl sulfone, ((Tribromomethyl)sulfonyl)benzene, Phenyl tribromomethyl sulfone, tribromomethylsulfonylbenzene, Benzene, [(tribromomethyl)sulfonyl]-
| Molecular Formula | C7H5Br3O2S |
|---|---|
| Molecular Weight | 389.76 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 391.754 |
| Heavy Atoms | 13 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 17025-47-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)C(Br)(Br)Br |
| InChIKey | DWWMSEANWMWMCB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
三溴甲基苯基砜 (CAS 17025-47-7), with molecular formula C7H5Br3O2S and molecular weight 389.76 g/mol. IUPAC: tribromomethylsulfonylbenzene.
Chemical Property Profile of 三溴甲基苯基砜
Property Insights of 三溴甲基苯基砜
The XLogP value of 3.9 indicates that 三溴甲基苯基砜 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, 三溴甲基苯基砜 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 三溴甲基苯基砜 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 三溴甲基苯基砜?
The CAS number of 三溴甲基苯基砜 is 17025-47-7.
What is the molecular formula of 三溴甲基苯基砜?
The molecular formula of 三溴甲基苯基砜 is C7H5Br3O2S.
What is the molecular weight of 三溴甲基苯基砜?
The molecular weight of 三溴甲基苯基砜 is 389.76 g/mol.
Where can I buy 三溴甲基苯基砜?
You can request a quote for 三溴甲基苯基砜 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三溴甲基苯基砜?
Yes, KEHONG BIO provides custom synthesis services for 三溴甲基苯基砜 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.