4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one
TL;DR: 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one (CAS 864751-14-4) is a chemical compound with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroxy-4-(imidazol-1-ylmethyl)chromen-2-one
Also Known As: 6-hydroxy-4-(imidazolylmethyl)chromen-2-one, VU0617009-1, 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one, 6-hydroxy-4-(imidazol-1-ylmethyl)chromen-2-one, 6-hydroxy-4-(1H-imidazol-1-ylmethyl)-2H-chromen-2-one
| Molecular Formula | C13H10N2O3 |
|---|---|
| Molecular Weight | 242.07 g/mol |
| LogP | 1.7434 |
| Topological Polar Surface Area | 68.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.06914 |
| Heavy Atoms | 18 |
| Complexity | 744.5174 |
Chemical Identifiers
| CAS Number | 864751-14-4 |
|---|---|
| SMILES | C1=CC2=C(C=C1O)C(=CC(=O)O2)CN3C=CN=C3 |
Product Overview
4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one (CAS 864751-14-4), with molecular formula C13H10N2O3 and molecular weight 242.07 g/mol. IUPAC: 6-hydroxy-4-(imidazol-1-ylmethyl)chromen-2-one.
Chemical Property Profile of 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one
Property Insights of 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one
The XLogP value of 1.7434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one. The TPSA of 68.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one. Following Lipinski's Rule of Five, 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one has 1 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 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one?
The CAS number of 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one is 864751-14-4.
What is the molecular formula of 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one?
The molecular formula of 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one is C13H10N2O3.
What is the molecular weight of 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one?
The molecular weight of 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one is 242.07 g/mol.
Where can I buy 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one?
You can request a quote for 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-((1H-imidazol-1-yl)methyl)-6-hydroxy-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.