Y-20811游离酸
TL;DR: Y-20811游离酸 (CAS 107433-19-2) is a chemical compound with molecular formula C20H20N2O3 and molecular weight 336.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Y-20811游离酸
4-[hydroxy-(5-imidazol-1-yl-2-methylphenyl)methyl]-3,5-dimethylbenzoic acid
Also Known As: Y-20811 free acid, J2.260.226H, Benzoic acid, 4-(hydroxy(5-(1H-imidazol-1-yl)-2-methylphenyl)methyl)-3,5-dimethyl-, 4-[alpha-Hydroxy-5-(1H-imidazole-1-yl)-2-methylbenzyl]-3,5-dimethylbenzoic acid, 4-[hydroxy-(5-imidazol-1-yl-2-methyl-phenyl)methyl]-3,5-dimethyl-benzoic Acid
| Molecular Formula | C20H20N2O3 |
|---|---|
| Molecular Weight | 336.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.1474 |
| Heavy Atoms | 25 |
| Complexity | 460.0 |
Chemical Identifiers
| CAS Number | 107433-19-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C=CN=C2)C(C3=C(C=C(C=C3C)C(=O)O)C)O |
| InChIKey | QSAHHFJAWATNBG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Y-20811游离酸 (CAS 107433-19-2), with molecular formula C20H20N2O3 and molecular weight 336.15 g/mol. IUPAC: 4-[hydroxy-(5-imidazol-1-yl-2-methylphenyl)methyl]-3,5-dimethylbenzoic acid.
Chemical Property Profile of Y-20811游离酸
Property Insights of Y-20811游离酸
The XLogP value of 3.1 indicates that Y-20811游离酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Y-20811游离酸. Following Lipinski's Rule of Five, Y-20811游离酸 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 Y-20811游离酸?
The CAS number of Y-20811游离酸 is 107433-19-2.
What is the molecular formula of Y-20811游离酸?
The molecular formula of Y-20811游离酸 is C20H20N2O3.
What is the molecular weight of Y-20811游离酸?
The molecular weight of Y-20811游离酸 is 336.15 g/mol.
Where can I buy Y-20811游离酸?
You can request a quote for Y-20811游离酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Y-20811游离酸?
Yes, KEHONG BIO provides custom synthesis services for Y-20811游离酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.