AB00428924-10
TL;DR: AB00428924-10 (CAS 862979-41-7) is a chemical compound with molecular formula C21H27FN6O2 and molecular weight 414.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-3-methyl-7-(2-methylpropyl)purine-2,6-dione
Also Known As: AB00428924-10, 8-((4-(2-fluorophenyl)piperazin-1-yl)methyl)-7-isobutyl-3-methyl-1H-purine-2,6(3H,7H)-dione, F0669-0159, 8-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-3-methyl-7-(2-methylpropyl)purine-2,6-dione, 8-{[4-(2-FLUOROPHENYL)PIPERAZIN-1-YL]METHYL}-3-METHYL-7-(2-METHYLPROPYL)-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE
| Molecular Formula | C21H27FN6O2 |
|---|---|
| Molecular Weight | 414.22 g/mol |
| LogP | 1.5406 |
| Topological Polar Surface Area | 79.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.21796 |
| Heavy Atoms | 30 |
| Complexity | 1170.4338 |
Chemical Identifiers
| CAS Number | 862979-41-7 |
|---|---|
| SMILES | CC(C)CN1C(=NC2=C1C(=O)NC(=O)N2C)CN3CCN(CC3)C4=CC=CC=C4F |
Product Overview
AB00428924-10 (CAS 862979-41-7), with molecular formula C21H27FN6O2 and molecular weight 414.22 g/mol. IUPAC: 8-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-3-methyl-7-(2-methylpropyl)purine-2,6-dione.
Chemical Property Profile of AB00428924-10
Property Insights of AB00428924-10
The XLogP value of 1.5406 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00428924-10. The TPSA of 79.16 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00428924-10. Following Lipinski's Rule of Five, AB00428924-10 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 AB00428924-10?
The CAS number of AB00428924-10 is 862979-41-7.
What is the molecular formula of AB00428924-10?
The molecular formula of AB00428924-10 is C21H27FN6O2.
What is the molecular weight of AB00428924-10?
The molecular weight of AB00428924-10 is 414.22 g/mol.
Where can I buy AB00428924-10?
You can request a quote for AB00428924-10 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00428924-10?
Yes, KEHONG BIO provides custom synthesis services for AB00428924-10 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.