RefChem:1079116
TL;DR: RefChem:1079116 (CAS 100037-28-3) is a chemical compound with molecular formula C19H16N2O5 and molecular weight 352.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4Z)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]benzoic acid
Also Known As: Benzoic acid, 4-(4,5-dihydro-4-((4-hydroxy-3-methoxyphenyl)methylene)-2-methyl-5-oxo-1H-imidazol-1-yl)-, Benzoic acid, p-(4-(4-hydroxy-3-methoxybenzylidene)-2-methyl-5-oxo-2-imidazolin-1-yl)-, p-(4-(4-Hydroxy-3-methoxybenzylidene)-2-methyl-5-oxo-2-imidazolin-1-yl)benzoic acid, BENZOIC ACID, 4-(4,5-DIHYDRO-4-((4-HYDROXY-3-METHOXYPHENYL)METHYLENE)-2-METHYL-5, 4-[(4Z)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]benzoic acid
| Molecular Formula | C19H16N2O5 |
|---|---|
| Molecular Weight | 352.11 g/mol |
| LogP | 2.9051 |
| Topological Polar Surface Area | 99.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 352.10593 |
| Heavy Atoms | 26 |
| Complexity | 944.90186 |
Chemical Identifiers
| CAS Number | 100037-28-3 |
|---|---|
| SMILES | CC1=N/C(=C\C2=CC(=C(C=C2)O)OC)/C(=O)N1C3=CC=C(C=C3)C(=O)O |
Product Overview
RefChem:1079116 (CAS 100037-28-3), with molecular formula C19H16N2O5 and molecular weight 352.11 g/mol. IUPAC: 4-[(4Z)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxoimidazol-1-yl]benzoic acid.
Chemical Property Profile of RefChem:1079116
Property Insights of RefChem:1079116
The XLogP value of 2.9051 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1079116. The TPSA of 99.43 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1079116. Following Lipinski's Rule of Five, RefChem:1079116 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 RefChem:1079116?
The CAS number of RefChem:1079116 is 100037-28-3.
What is the molecular formula of RefChem:1079116?
The molecular formula of RefChem:1079116 is C19H16N2O5.
What is the molecular weight of RefChem:1079116?
The molecular weight of RefChem:1079116 is 352.11 g/mol.
Where can I buy RefChem:1079116?
You can request a quote for RefChem:1079116 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1079116?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1079116 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.