2,2'-(Thiobis(methylene))bis-1H-benzimidazole
TL;DR: 2,2'-(Thiobis(methylene))bis-1H-benzimidazole (CAS 33007-61-3) is a chemical compound with molecular formula C16H14N4S and molecular weight 294.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylmethylsulfanylmethyl)-1H-benzimidazole
Also Known As: Thio-bis[1-methylbenzimidazole, Bis(2-benzimidazolylmethyl)sulfide, 2,2'-(Thiobis(methylene))bis-1H-benzimidazole, 2,2'-[Thiobis(methylene)]bis-1H-benzimidazole, Bis(1H-benzimidazole-2-ylmethyl) sulfide
| Molecular Formula | C16H14N4S |
|---|---|
| Molecular Weight | 294.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.0939 |
| Heavy Atoms | 21 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 33007-61-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)CSCC3=NC4=CC=CC=C4N3 |
| InChIKey | PLROPLMRAPJFHZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2'-(Thiobis(methylene))bis-1H-benzimidazole (CAS 33007-61-3), with molecular formula C16H14N4S and molecular weight 294.09 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylmethylsulfanylmethyl)-1H-benzimidazole.
Chemical Property Profile of 2,2'-(Thiobis(methylene))bis-1H-benzimidazole
Property Insights of 2,2'-(Thiobis(methylene))bis-1H-benzimidazole
The XLogP value of 3.1 indicates that 2,2'-(Thiobis(methylene))bis-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-(Thiobis(methylene))bis-1H-benzimidazole. Following Lipinski's Rule of Five, 2,2'-(Thiobis(methylene))bis-1H-benzimidazole has 2 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 2,2'-(Thiobis(methylene))bis-1H-benzimidazole?
The CAS number of 2,2'-(Thiobis(methylene))bis-1H-benzimidazole is 33007-61-3.
What is the molecular formula of 2,2'-(Thiobis(methylene))bis-1H-benzimidazole?
The molecular formula of 2,2'-(Thiobis(methylene))bis-1H-benzimidazole is C16H14N4S.
What is the molecular weight of 2,2'-(Thiobis(methylene))bis-1H-benzimidazole?
The molecular weight of 2,2'-(Thiobis(methylene))bis-1H-benzimidazole is 294.09 g/mol.
Where can I buy 2,2'-(Thiobis(methylene))bis-1H-benzimidazole?
You can request a quote for 2,2'-(Thiobis(methylene))bis-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-(Thiobis(methylene))bis-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-(Thiobis(methylene))bis-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.