咪唑-4-酮-5-丙酸
TL;DR: 咪唑-4-酮-5-丙酸 (CAS 17340-16-8) is a chemical compound with molecular formula C6H8N2O3 and molecular weight 156.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
咪唑-4-酮-5-丙酸
3-(5-oxo-1,4-dihydroimidazol-4-yl)propanoic acid
Also Known As: 4-imidazolone-5-propanoate, imidazolonepropanoate, Imidazol-4-one-5-propionic acid, imidazolone propionate, 4-imidazolone-5-propionic acid
| Molecular Formula | C6H8N2O3 |
|---|---|
| Molecular Weight | 156.05 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 78.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.0535 |
| Heavy Atoms | 11 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 17340-16-8 |
|---|---|
| SMILES | C1=NC(C(=O)N1)CCC(=O)O |
| InChIKey | HEXMLHKQVUFYME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
咪唑-4-酮-5-丙酸 (CAS 17340-16-8), with molecular formula C6H8N2O3 and molecular weight 156.05 g/mol. IUPAC: 3-(5-oxo-1,4-dihydroimidazol-4-yl)propanoic acid.
Chemical Property Profile of 咪唑-4-酮-5-丙酸
Property Insights of 咪唑-4-酮-5-丙酸
The XLogP value of -0.9 indicates that 咪唑-4-酮-5-丙酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 咪唑-4-酮-5-丙酸. Following Lipinski's Rule of Five, 咪唑-4-酮-5-丙酸 has 2 hydrogen bond donor(s) and 4 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 咪唑-4-酮-5-丙酸?
The CAS number of 咪唑-4-酮-5-丙酸 is 17340-16-8.
What is the molecular formula of 咪唑-4-酮-5-丙酸?
The molecular formula of 咪唑-4-酮-5-丙酸 is C6H8N2O3.
What is the molecular weight of 咪唑-4-酮-5-丙酸?
The molecular weight of 咪唑-4-酮-5-丙酸 is 156.05 g/mol.
Where can I buy 咪唑-4-酮-5-丙酸?
You can request a quote for 咪唑-4-酮-5-丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 咪唑-4-酮-5-丙酸?
Yes, KEHONG BIO provides custom synthesis services for 咪唑-4-酮-5-丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.