地巴唑
TL;DR: 地巴唑 (CAS 621-72-7) is a chemical compound with molecular formula C14H12N2 and molecular weight 208.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
地巴唑
2-benzyl-1H-benzimidazole
Also Known As: Bendazol, 2-Benzylbenzimidazole, Dibazole, Dibazol, Bendazole
| Molecular Formula | C14H12N2 |
|---|---|
| Molecular Weight | 208.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10005 |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
| Solubility | >31.2 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 621-72-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NC3=CC=CC=C3N2 |
| InChIKey | YTLQFZVCLXFFRK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
地巴唑 (CAS 621-72-7), with molecular formula C14H12N2 and molecular weight 208.10 g/mol. IUPAC: 2-benzyl-1H-benzimidazole.
Chemical Property Profile of 地巴唑
Property Insights of 地巴唑
The XLogP value of 3.2 indicates that 地巴唑 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.7 Ų, 地巴唑 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 地巴唑 has 1 hydrogen bond donor(s) and 1 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 地巴唑?
The CAS number of 地巴唑 is 621-72-7.
What is the molecular formula of 地巴唑?
The molecular formula of 地巴唑 is C14H12N2.
What is the molecular weight of 地巴唑?
The molecular weight of 地巴唑 is 208.10 g/mol.
Where can I buy 地巴唑?
You can request a quote for 地巴唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 地巴唑?
Yes, KEHONG BIO provides custom synthesis services for 地巴唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.