Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate
TL;DR: Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate (CAS 4929-62-8) is a chemical compound with molecular formula C34H35N9O14S and molecular weight 825.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[2-(4-propan-2-ylphenyl)sulfanylbenzimidazol-1-yl]ethanamine;bis(2,4,6-trinitrophenol)
Also Known As: Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate, 2-(p-Cumenylthio)-1-(2-(diethylamino)ethyl)benzimidazole dipicrate, 2,4,6-Trinitrophenol--N,N-diethyl-2-(2-{[4-(propan-2-yl)phenyl]sulfanyl}-1H-1,3-benzimidazol-1-yl)ethan-1-amine (2/1), N,N-diethyl-2-[2-(4-propan-2-ylphenyl)sulfanylbenzimidazol-1-yl]ethanamine; 2,4,6-trinitrophenol, RefChem:325871
| Molecular Formula | C34H35N9O14S |
|---|---|
| Molecular Weight | 825.20 g/mol |
| LogP | 7.8863 |
| Topological Polar Surface Area | 362.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 8 |
| Exact Mass | 825.2024 |
| Heavy Atoms | 58 |
| Complexity | 696.0 |
Chemical Identifiers
| CAS Number | 4929-62-8 |
|---|---|
| SMILES | CCN(CC)CCN1C2=CC=CC=C2N=C1SC3=CC=C(C=C3)C(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | YGEUURILQIXIJM-UHFFFAOYSA-N |
Product Overview
Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate (CAS 4929-62-8), with molecular formula C34H35N9O14S and molecular weight 825.20 g/mol. IUPAC: N,N-diethyl-2-[2-(4-propan-2-ylphenyl)sulfanylbenzimidazol-1-yl]ethanamine;bis(2,4,6-trinitrophenol).
Chemical Property Profile of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate
Property Insights of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate
The XLogP value of 7.8863 indicates that Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 362.0 Ų indicates high polarity, suggesting Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate has 2 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate?
The CAS number of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate is 4929-62-8.
What is the molecular formula of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate?
The molecular formula of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate is C34H35N9O14S.
What is the molecular weight of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate?
The molecular weight of Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate is 825.20 g/mol.
Where can I buy Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate?
You can request a quote for Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate?
Yes, KEHONG BIO provides custom synthesis services for Benzimidazole, 2-(p-cumenylthio)-1-(2-(diethylamino)ethyl)-, dipicrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.