(Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione
TL;DR: (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 398997-66-5) is a chemical compound with molecular formula C18H21FN6O2 and molecular weight 372.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2Z)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-3-methyl-7-(3-methylbutyl)purine-2,6-dione
Also Known As: (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione, F0839-0045, 8-[(2Z)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-3-methyl-7-(3-methylbutyl)purine-2,6-dione
| Molecular Formula | C18H21FN6O2 |
|---|---|
| Molecular Weight | 372.17 g/mol |
| LogP | 2.0545 |
| Topological Polar Surface Area | 97.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.171 |
| Heavy Atoms | 27 |
| Complexity | 1091.9678 |
Chemical Identifiers
| CAS Number | 398997-66-5 |
|---|---|
| SMILES | CC(C)CCN1C2=C(N=C1N/N=C\C3=CC=C(C=C3)F)N(C(=O)NC2=O)C |
Product Overview
(Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione (CAS 398997-66-5), with molecular formula C18H21FN6O2 and molecular weight 372.17 g/mol. IUPAC: 8-[(2Z)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-3-methyl-7-(3-methylbutyl)purine-2,6-dione.
Chemical Property Profile of (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione
Property Insights of (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 2.0545 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione. The TPSA of 97.07 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione has 2 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 (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione is 398997-66-5.
What is the molecular formula of (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione is C18H21FN6O2.
What is the molecular weight of (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione is 372.17 g/mol.
Where can I buy (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (Z)-8-(2-(4-fluorobenzylidene)hydrazinyl)-7-isopentyl-3-methyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.