A2028/0085153
TL;DR: A2028/0085153 (CAS 312533-29-2) is a chemical compound with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl)-2-(2-methylphenoxy)ethanone
Also Known As: A2028/0085153, 1-(5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl)-2-(2-methylphenoxy)ethanone, 3-methyl-1-[(2-methylphenoxy)acetyl]-5-(3-pyridinyl)-4,5-dihydro-1H-pyrazol-5-ol, 1-(5-hydroxy-3-methyl-5-(pyridin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl)-2-(o-tolyloxy)ethanone, 1-[5-HYDROXY-3-METHYL-5-(PYRIDIN-3-YL)-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-2-(2-METHYLPHENOXY)ETHAN-1-ONE
| Molecular Formula | C18H19N3O3 |
|---|---|
| Molecular Weight | 325.14 g/mol |
| LogP | 2.22232 |
| Topological Polar Surface Area | 75.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 325.14264 |
| Heavy Atoms | 24 |
| Complexity | 776.08826 |
Chemical Identifiers
| CAS Number | 312533-29-2 |
|---|---|
| SMILES | CC1=NN(C(C1)(C2=CN=CC=C2)O)C(=O)COC3=CC=CC=C3C |
Product Overview
A2028/0085153 (CAS 312533-29-2), with molecular formula C18H19N3O3 and molecular weight 325.14 g/mol. IUPAC: 1-(5-hydroxy-3-methyl-5-pyridin-3-yl-4H-pyrazol-1-yl)-2-(2-methylphenoxy)ethanone.
Chemical Property Profile of A2028/0085153
Property Insights of A2028/0085153
The XLogP value of 2.22232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2028/0085153. The TPSA of 75.02 Ų falls within the moderate polarity range, balancing permeability and solubility for A2028/0085153. Following Lipinski's Rule of Five, A2028/0085153 has 1 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 A2028/0085153?
The CAS number of A2028/0085153 is 312533-29-2.
What is the molecular formula of A2028/0085153?
The molecular formula of A2028/0085153 is C18H19N3O3.
What is the molecular weight of A2028/0085153?
The molecular weight of A2028/0085153 is 325.14 g/mol.
Where can I buy A2028/0085153?
You can request a quote for A2028/0085153 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2028/0085153?
Yes, KEHONG BIO provides custom synthesis services for A2028/0085153 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.