(1H-imidazol-4-yl)(phenyl)methanone
TL;DR: (1H-imidazol-4-yl)(phenyl)methanone (CAS 61985-32-8) is a chemical compound with molecular formula C10H8N2O and molecular weight 172.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-imidazol-5-yl(phenyl)methanone
Also Known As: 4-Benzoylimidazole, (1H-imidazol-4-yl)(phenyl)methanone, 4-BENZOYL-1H-IMIDAZOLE, 1H-Imidazol-5-yl(phenyl)methanone, 5-benzoyl-1H-imidazole
| Molecular Formula | C10H8N2O |
|---|---|
| Molecular Weight | 172.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.06366 |
| Heavy Atoms | 13 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 61985-32-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=CN=CN2 |
| InChIKey | DECHVIXTYBTMBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1H-imidazol-4-yl)(phenyl)methanone (CAS 61985-32-8), with molecular formula C10H8N2O and molecular weight 172.06 g/mol. IUPAC: 1H-imidazol-5-yl(phenyl)methanone.
Chemical Property Profile of (1H-imidazol-4-yl)(phenyl)methanone
Property Insights of (1H-imidazol-4-yl)(phenyl)methanone
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1H-imidazol-4-yl)(phenyl)methanone. With a topological polar surface area (TPSA) of 45.8 Ų, (1H-imidazol-4-yl)(phenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1H-imidazol-4-yl)(phenyl)methanone has 1 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 (1H-imidazol-4-yl)(phenyl)methanone?
The CAS number of (1H-imidazol-4-yl)(phenyl)methanone is 61985-32-8.
What is the molecular formula of (1H-imidazol-4-yl)(phenyl)methanone?
The molecular formula of (1H-imidazol-4-yl)(phenyl)methanone is C10H8N2O.
What is the molecular weight of (1H-imidazol-4-yl)(phenyl)methanone?
The molecular weight of (1H-imidazol-4-yl)(phenyl)methanone is 172.06 g/mol.
Where can I buy (1H-imidazol-4-yl)(phenyl)methanone?
You can request a quote for (1H-imidazol-4-yl)(phenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1H-imidazol-4-yl)(phenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (1H-imidazol-4-yl)(phenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.