F1064-0072
TL;DR: F1064-0072 (CAS 682775-97-9) is a chemical compound with molecular formula C20H26N6O4 and molecular weight 414.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-hydroxy-3-propan-2-yloxypropyl)-3-methyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]purine-2,6-dione
Also Known As: F1064-0072, 4-methylbenzaldehyde [7-(2-hydroxy-3-isopropoxypropyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone, 7-[2-hydroxy-3-(propan-2-yloxy)propyl]-3-methyl-8-[(E)-2-[(4-methylphenyl)methylidene]hydrazin-1-yl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione, (E)-7-(2-hydroxy-3-isopropoxypropyl)-3-methyl-8-(2-(4-methylbenzylidene)hydrazinyl)-1H-purine-2,6(3H,7H)-dione, 7-(2-hydroxy-3-propan-2-yloxypropyl)-3-methyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]purine-2,6-dione
| Molecular Formula | C20H26N6O4 |
|---|---|
| Molecular Weight | 414.20 g/mol |
| LogP | 0.96362 |
| Topological Polar Surface Area | 126.53 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.20154 |
| Heavy Atoms | 30 |
| Complexity | 1156.9839 |
Chemical Identifiers
| CAS Number | 682775-97-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=N/NC2=NC3=C(N2CC(COC(C)C)O)C(=O)NC(=O)N3C |
Product Overview
F1064-0072 (CAS 682775-97-9), with molecular formula C20H26N6O4 and molecular weight 414.20 g/mol. IUPAC: 7-(2-hydroxy-3-propan-2-yloxypropyl)-3-methyl-8-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]purine-2,6-dione.
Chemical Property Profile of F1064-0072
Property Insights of F1064-0072
The XLogP value of 0.96362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1064-0072. The TPSA of 126.53 Ų falls within the moderate polarity range, balancing permeability and solubility for F1064-0072. Following Lipinski's Rule of Five, F1064-0072 has 3 hydrogen bond donor(s) and 7 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 F1064-0072?
The CAS number of F1064-0072 is 682775-97-9.
What is the molecular formula of F1064-0072?
The molecular formula of F1064-0072 is C20H26N6O4.
What is the molecular weight of F1064-0072?
The molecular weight of F1064-0072 is 414.20 g/mol.
Where can I buy F1064-0072?
You can request a quote for F1064-0072 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1064-0072?
Yes, KEHONG BIO provides custom synthesis services for F1064-0072 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.