2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol
TL;DR: 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol (CAS 332886-13-2) is a chemical compound with molecular formula C15H13N3O and molecular weight 251.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1-methylbenzimidazol-5-yl)iminomethyl]phenol
Also Known As: BAS 00619488, 2-[(1-Methyl-1H-benzoimidazol-5-ylimino)-methyl]-phenol, 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol, (E)-2-(((1-methyl-1H-benzo[d]imidazol-5-yl)imino)methyl)phenol, 6-[[(1-methylbenzimidazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C15H13N3O |
|---|---|
| Molecular Weight | 251.11 g/mol |
| LogP | 3.0295 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.10587 |
| Heavy Atoms | 19 |
| Complexity | 758.9266 |
Chemical Identifiers
| CAS Number | 332886-13-2 |
|---|---|
| SMILES | CN1C=NC2=C1C=CC(=C2)N=CC3=CC=CC=C3O |
Product Overview
2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol (CAS 332886-13-2), with molecular formula C15H13N3O and molecular weight 251.11 g/mol. IUPAC: 2-[(1-methylbenzimidazol-5-yl)iminomethyl]phenol.
Chemical Property Profile of 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol
Property Insights of 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol
The XLogP value of 3.0295 indicates that 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.41 Ų, 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol has 1 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-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol?
The CAS number of 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol is 332886-13-2.
What is the molecular formula of 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol?
The molecular formula of 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol is C15H13N3O.
What is the molecular weight of 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol?
The molecular weight of 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol is 251.11 g/mol.
Where can I buy 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol?
You can request a quote for 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-{(E)-[(1-methyl-1H-benzimidazol-5-yl)imino]methyl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.