![1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole structure](/static/products/4962/49629-31-4.webp)
1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole
TL;DR: 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole (CAS 49629-31-4) is a chemical compound with molecular formula C16H14N4 and molecular weight 262.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(benzimidazol-1-yl)ethyl]benzimidazole
Also Known As: 1,2-bis(1-benzimidazolyl)ethane, (2-benzimidazolylethyl)benzimidazole, SDCCGMLS-0037945.P002, 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole, 1,1'-ethane-1,2-diylbis(1H-benzimidazole)
| Molecular Formula | C16H14N4 |
|---|---|
| Molecular Weight | 262.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.12186 |
| Heavy Atoms | 20 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 49629-31-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CN2CCN3C=NC4=CC=CC=C43 |
| InChIKey | ZYKAOPWVCXDORK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole (CAS 49629-31-4), with molecular formula C16H14N4 and molecular weight 262.12 g/mol. IUPAC: 1-[2-(benzimidazol-1-yl)ethyl]benzimidazole.
Chemical Property Profile of 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole
Property Insights of 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole. With a topological polar surface area (TPSA) of 35.6 Ų, 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole has 0 hydrogen bond donor(s) and 2 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 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole?
The CAS number of 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole is 49629-31-4.
What is the molecular formula of 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole?
The molecular formula of 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole is C16H14N4.
What is the molecular weight of 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole?
The molecular weight of 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole is 262.12 g/mol.
Where can I buy 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole?
You can request a quote for 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(1H-1,3-benzodiazol-1-yl)ethyl]-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.