5-甲基-2-苯基-1H-咪唑-4-甲酸
TL;DR: 5-甲基-2-苯基-1H-咪唑-4-甲酸 (CAS 28824-94-4) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-甲基-2-苯基-1H-咪唑-4-甲酸
5-methyl-2-phenyl-1H-imidazole-4-carboxylic acid
Also Known As: 5-Methyl-2-phenyl-1H-imidazole-4-carboxylic acid, null, 4-methyl-2-phenyl-1H-imidazole-5-carboxylic acid, 1H-Imidazole-5-carboxylic acid, 4-methyl-2-phenyl-, 5-Methyl-2-phenylimidazol-4-carbonsaeure
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 28824-94-4 |
|---|---|
| SMILES | CC1=C(N=C(N1)C2=CC=CC=C2)C(=O)O |
| InChIKey | NEDPOZZCAYIDNP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-甲基-2-苯基-1H-咪唑-4-甲酸 (CAS 28824-94-4), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: 5-methyl-2-phenyl-1H-imidazole-4-carboxylic acid.
Chemical Property Profile of 5-甲基-2-苯基-1H-咪唑-4-甲酸
Property Insights of 5-甲基-2-苯基-1H-咪唑-4-甲酸
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-甲基-2-苯基-1H-咪唑-4-甲酸. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-甲基-2-苯基-1H-咪唑-4-甲酸. Following Lipinski's Rule of Five, 5-甲基-2-苯基-1H-咪唑-4-甲酸 has 2 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 5-甲基-2-苯基-1H-咪唑-4-甲酸?
The CAS number of 5-甲基-2-苯基-1H-咪唑-4-甲酸 is 28824-94-4.
What is the molecular formula of 5-甲基-2-苯基-1H-咪唑-4-甲酸?
The molecular formula of 5-甲基-2-苯基-1H-咪唑-4-甲酸 is C11H10N2O2.
What is the molecular weight of 5-甲基-2-苯基-1H-咪唑-4-甲酸?
The molecular weight of 5-甲基-2-苯基-1H-咪唑-4-甲酸 is 202.07 g/mol.
Where can I buy 5-甲基-2-苯基-1H-咪唑-4-甲酸?
You can request a quote for 5-甲基-2-苯基-1H-咪唑-4-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-甲基-2-苯基-1H-咪唑-4-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 5-甲基-2-苯基-1H-咪唑-4-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.