![2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol structure](/static/products/863/86366-94-1.png)
2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol
TL;DR: 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol (CAS 86366-94-1) is a chemical compound with molecular formula C22H30Cl2N2O2S and molecular weight 456.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol
Also Known As: 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol, 2,2'-Sulfanediylbis{6-[(tert-butylamino)methyl]-4-chlorophenol}
| Molecular Formula | C22H30Cl2N2O2S |
|---|---|
| Molecular Weight | 456.14 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 89.8 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.1405 |
| Heavy Atoms | 29 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 86366-94-1 |
|---|---|
| SMILES | CC(C)(C)NCC1=C(C(=CC(=C1)Cl)SC2=CC(=CC(=C2O)CNC(C)(C)C)Cl)O |
| InChIKey | OMTCCLVGULLKBH-UHFFFAOYSA-N |
Product Overview
2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol (CAS 86366-94-1), with molecular formula C22H30Cl2N2O2S and molecular weight 456.14 g/mol. IUPAC: 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol.
Chemical Property Profile of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol
Property Insights of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol
The XLogP value of 6.3 indicates that 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol. Following Lipinski's Rule of Five, 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol?
The CAS number of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol is 86366-94-1.
What is the molecular formula of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol?
The molecular formula of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol is C22H30Cl2N2O2S.
What is the molecular weight of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol?
The molecular weight of 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol is 456.14 g/mol.
Where can I buy 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol?
You can request a quote for 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(tert-butylamino)methyl]-6-[3-[(tert-butylamino)methyl]-5-chloro-2-hydroxyphenyl]sulfanyl-4-chlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.