Hexakis(4-aminophenylthiomethyl)benzene
TL;DR: Hexakis(4-aminophenylthiomethyl)benzene (CAS 72031-82-4) is a chemical compound with molecular formula C48H48N6S6 and molecular weight 900.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[2,3,4,5,6-pentakis[(4-aminophenyl)sulfanylmethyl]phenyl]methylsulfanyl]aniline
Also Known As: HEXAKIS(4-AMINOPHENYLTHIOMETHYL)BENZENE, 4-[[2,3,4,5,6-pentakis[(4-aminophenyl)sulfanylmethyl]phenyl]methylsulfanyl]aniline, 4,4',4'',4''',4'''',4'''''-((Benzene-1,2,3,4,5,6-hexaylhexakis(methylene))hexakis(sulfanediyl))hexaaniline, 662-782-5, RefChem:786189
| Molecular Formula | C48H48N6S6 |
|---|---|
| Molecular Weight | 900.23 g/mol |
| LogP | 12.9336 |
| Topological Polar Surface Area | 156.12 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 18 |
| Exact Mass | 900.2265 |
| Heavy Atoms | 60 |
| Complexity | 1988.5284 |
Chemical Identifiers
| CAS Number | 72031-82-4 |
|---|---|
| SMILES | C1=CC(=CC=C1N)SCC2=C(C(=C(C(=C2CSC3=CC=C(C=C3)N)CSC4=CC=C(C=C4)N)CSC5=CC=C(C=C5)N)CSC6=CC=C(C=C6)N)CSC7=CC=C(C=C7)N |
Product Overview
Hexakis(4-aminophenylthiomethyl)benzene (CAS 72031-82-4), with molecular formula C48H48N6S6 and molecular weight 900.23 g/mol. IUPAC: 4-[[2,3,4,5,6-pentakis[(4-aminophenyl)sulfanylmethyl]phenyl]methylsulfanyl]aniline.
Chemical Property Profile of Hexakis(4-aminophenylthiomethyl)benzene
Property Insights of Hexakis(4-aminophenylthiomethyl)benzene
The XLogP value of 12.9336 indicates that Hexakis(4-aminophenylthiomethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.12 Ų indicates high polarity, suggesting Hexakis(4-aminophenylthiomethyl)benzene may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hexakis(4-aminophenylthiomethyl)benzene has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexakis(4-aminophenylthiomethyl)benzene?
The CAS number of Hexakis(4-aminophenylthiomethyl)benzene is 72031-82-4.
What is the molecular formula of Hexakis(4-aminophenylthiomethyl)benzene?
The molecular formula of Hexakis(4-aminophenylthiomethyl)benzene is C48H48N6S6.
What is the molecular weight of Hexakis(4-aminophenylthiomethyl)benzene?
The molecular weight of Hexakis(4-aminophenylthiomethyl)benzene is 900.23 g/mol.
Where can I buy Hexakis(4-aminophenylthiomethyl)benzene?
You can request a quote for Hexakis(4-aminophenylthiomethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexakis(4-aminophenylthiomethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for Hexakis(4-aminophenylthiomethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.