AB01278422-01
TL;DR: AB01278422-01 (CAS 840464-27-9) is a chemical compound with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(1-oxo-1-phenylbutan-2-yl)purine-2,6-dione
Also Known As: AB01278422-01, 1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(1-oxo-1-phenylbutan-2-yl)-1H-purine-2,6(3H,7H)-dione, 1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(1-oxo-1-phenylbutan-2-yl)-3,7-dihydro-1H-purine-2,6-dione, 1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(1-oxo-1-phenyl-butan-2-yl)purine-2,6-dione, 1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(1-oxo-1-phenylbutan-2-yl)purine-2,6-dione
| Molecular Formula | C22H28N6O3 |
|---|---|
| Molecular Weight | 424.22 g/mol |
| LogP | 1.0195 |
| Topological Polar Surface Area | 85.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.2223 |
| Heavy Atoms | 31 |
| Complexity | 1232.0952 |
Chemical Identifiers
| CAS Number | 840464-27-9 |
|---|---|
| SMILES | CCC(C(=O)C1=CC=CC=C1)N2C3=C(N=C2N4CCN(CC4)C)N(C(=O)N(C3=O)C)C |
Product Overview
AB01278422-01 (CAS 840464-27-9), with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol. IUPAC: 1,3-dimethyl-8-(4-methylpiperazin-1-yl)-7-(1-oxo-1-phenylbutan-2-yl)purine-2,6-dione.
Chemical Property Profile of AB01278422-01
Property Insights of AB01278422-01
The XLogP value of 1.0195 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01278422-01. The TPSA of 85.37 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01278422-01. Following Lipinski's Rule of Five, AB01278422-01 has 0 hydrogen bond donor(s) and 6 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 AB01278422-01?
The CAS number of AB01278422-01 is 840464-27-9.
What is the molecular formula of AB01278422-01?
The molecular formula of AB01278422-01 is C22H28N6O3.
What is the molecular weight of AB01278422-01?
The molecular weight of AB01278422-01 is 424.22 g/mol.
Where can I buy AB01278422-01?
You can request a quote for AB01278422-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01278422-01?
Yes, KEHONG BIO provides custom synthesis services for AB01278422-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.