F1064-0031
TL;DR: F1064-0031 (CAS 682775-87-7) is a chemical compound with molecular formula C19H23FN6O3 and molecular weight 402.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-fluorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpurine-2,6-dione
Also Known As: F1064-0031, 7-(4-fluorobenzyl)-8-(4-(2-hydroxyethyl)piperazin-1-yl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 7-[(4-fluorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpurine-2,6-dione, 7-[(4-fluorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 7-[(4-fluorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methyl-purine-2,6-dione
| Molecular Formula | C19H23FN6O3 |
|---|---|
| Molecular Weight | 402.18 g/mol |
| LogP | -0.275 |
| Topological Polar Surface Area | 99.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.18158 |
| Heavy Atoms | 29 |
| Complexity | 1125.7825 |
Chemical Identifiers
| CAS Number | 682775-87-7 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)CCO)CC4=CC=C(C=C4)F |
Product Overview
F1064-0031 (CAS 682775-87-7), with molecular formula C19H23FN6O3 and molecular weight 402.18 g/mol. IUPAC: 7-[(4-fluorophenyl)methyl]-8-[4-(2-hydroxyethyl)piperazin-1-yl]-3-methylpurine-2,6-dione.
Chemical Property Profile of F1064-0031
Property Insights of F1064-0031
The XLogP value of -0.275 indicates that F1064-0031 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.39 Ų falls within the moderate polarity range, balancing permeability and solubility for F1064-0031. Following Lipinski's Rule of Five, F1064-0031 has 2 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 F1064-0031?
The CAS number of F1064-0031 is 682775-87-7.
What is the molecular formula of F1064-0031?
The molecular formula of F1064-0031 is C19H23FN6O3.
What is the molecular weight of F1064-0031?
The molecular weight of F1064-0031 is 402.18 g/mol.
Where can I buy F1064-0031?
You can request a quote for F1064-0031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1064-0031?
Yes, KEHONG BIO provides custom synthesis services for F1064-0031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.