2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride
TL;DR: 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride (CAS 73688-73-0) is a chemical compound with molecular formula C14H14ClN3OS and molecular weight 307.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-hydroxyanilino)methyl]-1H-benzimidazole-2-thione;hydrochloride
Also Known As: Phenol, hydrochloride, 2-Benzimidazolethiol, hydrochloride, 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride, 4-((2-Mercaptobenzimidazolylmethyl)-amino)-phenol, 4-((2-Mercaptobenzimidazolylmethyl)amino)phenol hydrochloride
| Molecular Formula | C14H14ClN3OS |
|---|---|
| Molecular Weight | 307.05 g/mol |
| LogP | 3.89589 |
| Topological Polar Surface Area | 52.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 307.0546 |
| Heavy Atoms | 20 |
| Complexity | 763.9351 |
Chemical Identifiers
| CAS Number | 73688-73-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=S)N2CNC3=CC=C(C=C3)O.Cl |
Product Overview
2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride (CAS 73688-73-0), with molecular formula C14H14ClN3OS and molecular weight 307.05 g/mol. IUPAC: 3-[(4-hydroxyanilino)methyl]-1H-benzimidazole-2-thione;hydrochloride.
Chemical Property Profile of 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride
Property Insights of 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride
The XLogP value of 3.89589 indicates that 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.98 Ų, 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride has 3 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-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride?
The CAS number of 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride is 73688-73-0.
What is the molecular formula of 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride?
The molecular formula of 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride is C14H14ClN3OS.
What is the molecular weight of 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride?
The molecular weight of 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride is 307.05 g/mol.
Where can I buy 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride?
You can request a quote for 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzimidazolethiol, 1-(4-hydroxyanilinomethyl)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.