4-溴甲基-2-苯基-1,3-二硫杂环戊烷
TL;DR: 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 (CAS 35128-29-1) is a chemical compound with molecular formula C10H11BrS2 and molecular weight 273.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-溴甲基-2-苯基-1,3-二硫杂环戊烷
4-(bromomethyl)-2-phenyl-1,3-dithiolane
Also Known As: 4-Bromomethyl-2-phenyl-1,3-dithiolane, 4-(bromomethyl)-2-phenyl-1,3-dithiolane, 1,3-DITHIOLANE, 4-BROMOMETHYL-2-PHENYL-, 4-Bromomethyl 2-Phenyl 1,3-Dithiolane, 4-bromomethyl-2-phenyl-[1,3]dithiolane
| Molecular Formula | C10H11BrS2 |
|---|---|
| Molecular Weight | 273.95 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.94855 |
| Heavy Atoms | 13 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 35128-29-1 |
|---|---|
| SMILES | C1C(SC(S1)C2=CC=CC=C2)CBr |
| InChIKey | VLCNHILPYWCOQE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-溴甲基-2-苯基-1,3-二硫杂环戊烷 (CAS 35128-29-1), with molecular formula C10H11BrS2 and molecular weight 273.95 g/mol. IUPAC: 4-(bromomethyl)-2-phenyl-1,3-dithiolane.
Chemical Property Profile of 4-溴甲基-2-苯基-1,3-二硫杂环戊烷
Property Insights of 4-溴甲基-2-苯基-1,3-二硫杂环戊烷
The XLogP value of 3.8 indicates that 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 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 4-溴甲基-2-苯基-1,3-二硫杂环戊烷?
The CAS number of 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 is 35128-29-1.
What is the molecular formula of 4-溴甲基-2-苯基-1,3-二硫杂环戊烷?
The molecular formula of 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 is C10H11BrS2.
What is the molecular weight of 4-溴甲基-2-苯基-1,3-二硫杂环戊烷?
The molecular weight of 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 is 273.95 g/mol.
Where can I buy 4-溴甲基-2-苯基-1,3-二硫杂环戊烷?
You can request a quote for 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-溴甲基-2-苯基-1,3-二硫杂环戊烷?
Yes, KEHONG BIO provides custom synthesis services for 4-溴甲基-2-苯基-1,3-二硫杂环戊烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.