2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷
TL;DR: 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 (CAS 31362-12-6) is a chemical compound with molecular formula C11H15NS2 and molecular weight 225.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷
4-(1,3-dithiolan-2-yl)-N,N-dimethylaniline
Also Known As: 1,3-DITHIOLANE, 2-(p-(DIMETHYLAMINO)PHENYL)-, 2-(p-(Dimethylamino)phenyl)-1,3-dithiolane, 4-(1,3-dithiolan-2-yl)-N,N-dimethylaniline, 2-(4'-Dimethylaminophenyl)-1,3-dithiolane, 2-[4-(Dimethylamino)phenyl]-1,3-dithiolane
| Molecular Formula | C11H15NS2 |
|---|---|
| Molecular Weight | 225.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 53.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.06459 |
| Heavy Atoms | 14 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 31362-12-6 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C2SCCS2 |
| InChIKey | ILIUITZNOPFHKC-UHFFFAOYSA-N |
Product Overview
2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 (CAS 31362-12-6), with molecular formula C11H15NS2 and molecular weight 225.06 g/mol. IUPAC: 4-(1,3-dithiolan-2-yl)-N,N-dimethylaniline.
Chemical Property Profile of 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷
Property Insights of 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷
The XLogP value of 3.0 indicates that 2-(4'-二甲氨基苯基)-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 53.8 Ų, 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 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 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷?
The CAS number of 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 is 31362-12-6.
What is the molecular formula of 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷?
The molecular formula of 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 is C11H15NS2.
What is the molecular weight of 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷?
The molecular weight of 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 is 225.06 g/mol.
Where can I buy 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷?
You can request a quote for 2-(4'-二甲氨基苯基)-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 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷?
Yes, KEHONG BIO provides custom synthesis services for 2-(4'-二甲氨基苯基)-1,3-二硫杂环戊烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.