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1-Benzyl-1H-benzo[d]imidazol-2(3H)-one
TL;DR: 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one (CAS 28643-53-0) is a chemical compound with molecular formula C14H12N2O and molecular weight 224.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-1H-benzimidazol-2-one
Also Known As: 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one, 3-benzyl-1H-benzimidazol-2-one, 1-Benzylbenzimidazol-2(3H)-one, 2-Benzimidazolinone, 1-benzyl-, 1-benzyl-3-hydrobenzimidazol-2-one
| Molecular Formula | C14H12N2O |
|---|---|
| Molecular Weight | 224.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.09496 |
| Heavy Atoms | 17 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 28643-53-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=CC=CC=C3NC2=O |
| InChIKey | AUGPRLHZAOPVIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Benzyl-1H-benzo[d]imidazol-2(3H)-one (CAS 28643-53-0), with molecular formula C14H12N2O and molecular weight 224.09 g/mol. IUPAC: 3-benzyl-1H-benzimidazol-2-one.
Chemical Property Profile of 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one
Property Insights of 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one. With a topological polar surface area (TPSA) of 32.3 Ų, 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one 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 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one?
The CAS number of 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one is 28643-53-0.
What is the molecular formula of 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one?
The molecular formula of 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one is C14H12N2O.
What is the molecular weight of 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one?
The molecular weight of 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one is 224.09 g/mol.
Where can I buy 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one?
You can request a quote for 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-1H-benzo[d]imidazol-2(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.