5-BROMOIMAZAPYR
TL;DR: 5-BROMOIMAZAPYR (CAS 81335-08-2) is a chemical compound with molecular formula C13H14BrN3O3 and molecular weight 339.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid
Also Known As: 5-BROMOIMAZAPYR, 3-Pyridinecarboxylic acid, 5-bromo-2-(4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl)-, 5-bromo-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic Acid, 5-Bromo-2-[5-methyl-4-oxo-5-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]pyridine-3-carboxylic acid
| Molecular Formula | C13H14BrN3O3 |
|---|---|
| Molecular Weight | 339.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.02185 |
| Heavy Atoms | 20 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 81335-08-2 |
|---|---|
| SMILES | CC(C)C1(C(=O)NC(=N1)C2=C(C=C(C=N2)Br)C(=O)O)C |
| InChIKey | LHFKLAXWQGHVIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-BROMOIMAZAPYR (CAS 81335-08-2), with molecular formula C13H14BrN3O3 and molecular weight 339.02 g/mol. IUPAC: 5-bromo-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid.
Chemical Property Profile of 5-BROMOIMAZAPYR
Property Insights of 5-BROMOIMAZAPYR
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-BROMOIMAZAPYR. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-BROMOIMAZAPYR. Following Lipinski's Rule of Five, 5-BROMOIMAZAPYR has 2 hydrogen bond donor(s) and 5 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-BROMOIMAZAPYR?
The CAS number of 5-BROMOIMAZAPYR is 81335-08-2.
What is the molecular formula of 5-BROMOIMAZAPYR?
The molecular formula of 5-BROMOIMAZAPYR is C13H14BrN3O3.
What is the molecular weight of 5-BROMOIMAZAPYR?
The molecular weight of 5-BROMOIMAZAPYR is 339.02 g/mol.
Where can I buy 5-BROMOIMAZAPYR?
You can request a quote for 5-BROMOIMAZAPYR directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-BROMOIMAZAPYR?
Yes, KEHONG BIO provides custom synthesis services for 5-BROMOIMAZAPYR and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.