A2B receptor antagonist 1
TL;DR: A2B receptor antagonist 1 (CAS 531506-36-2) is a chemical compound with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(1-benzylpyrazol-4-yl)-1,3-dipropyl-7H-purine-2,6-dione
Also Known As: A2B receptor antagonist 1, HY-U00321, 8-(1-benzylpyrazol-4-yl)-1,3-dipropyl-7H-purine-2,6-dione, 8-(1-benzyl-1H-pyrazol-4-yl)-1,3-dipropyl-1H-purine-2,6(3H,7H)-dione, 8-(1-benzyl-1H-pyrazol-4-yl)-1,3-dipropyl-1H-purine-2,6-(3H,7H)-dione
| Molecular Formula | C21H24N6O2 |
|---|---|
| Molecular Weight | 392.20 g/mol |
| LogP | 2.6181 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.19608 |
| Heavy Atoms | 29 |
| Complexity | 1245.8965 |
Chemical Identifiers
| CAS Number | 531506-36-2 |
|---|---|
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CN(N=C3)CC4=CC=CC=C4 |
Product Overview
A2B receptor antagonist 1 (CAS 531506-36-2), with molecular formula C21H24N6O2 and molecular weight 392.20 g/mol. IUPAC: 8-(1-benzylpyrazol-4-yl)-1,3-dipropyl-7H-purine-2,6-dione.
Chemical Property Profile of A2B receptor antagonist 1
Property Insights of A2B receptor antagonist 1
The XLogP value of 2.6181 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2B receptor antagonist 1. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for A2B receptor antagonist 1. Following Lipinski's Rule of Five, A2B receptor antagonist 1 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 A2B receptor antagonist 1?
The CAS number of A2B receptor antagonist 1 is 531506-36-2.
What is the molecular formula of A2B receptor antagonist 1?
The molecular formula of A2B receptor antagonist 1 is C21H24N6O2.
What is the molecular weight of A2B receptor antagonist 1?
The molecular weight of A2B receptor antagonist 1 is 392.20 g/mol.
Where can I buy A2B receptor antagonist 1?
You can request a quote for A2B receptor antagonist 1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2B receptor antagonist 1?
Yes, KEHONG BIO provides custom synthesis services for A2B receptor antagonist 1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.