F1717-0005
TL;DR: F1717-0005 (CAS 714233-02-0) is a chemical compound with molecular formula C21H20ClN5O2 and molecular weight 409.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(2-chlorophenyl)methylamino]-3-methyl-7-[(2-methylphenyl)methyl]purine-2,6-dione
Also Known As: F1717-0005, 8-((2-chlorobenzyl)amino)-3-methyl-7-(2-methylbenzyl)-1H-purine-2,6(3H,7H)-dione, 8-[(2-chlorophenyl)methylamino]-3-methyl-7-[(2-methylphenyl)methyl]purine-2,6-dione, 8-{[(2-chlorophenyl)methyl]amino}-3-methyl-7-[(2-methylphenyl)methyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 8-[(2-chlorobenzyl)amino]-6-hydroxy-3-methyl-7-(2-methylbenzyl)-3,7-dihydro-2H-purin-2-one
| Molecular Formula | C21H20ClN5O2 |
|---|---|
| Molecular Weight | 409.13 g/mol |
| LogP | 3.04552 |
| Topological Polar Surface Area | 84.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.13055 |
| Heavy Atoms | 29 |
| Complexity | 1318.8885 |
Chemical Identifiers
| CAS Number | 714233-02-0 |
|---|---|
| SMILES | CC1=CC=CC=C1CN2C3=C(N=C2NCC4=CC=CC=C4Cl)N(C(=O)NC3=O)C |
Product Overview
F1717-0005 (CAS 714233-02-0), with molecular formula C21H20ClN5O2 and molecular weight 409.13 g/mol. IUPAC: 8-[(2-chlorophenyl)methylamino]-3-methyl-7-[(2-methylphenyl)methyl]purine-2,6-dione.
Chemical Property Profile of F1717-0005
Property Insights of F1717-0005
The XLogP value of 3.04552 indicates that F1717-0005 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.71 Ų falls within the moderate polarity range, balancing permeability and solubility for F1717-0005. Following Lipinski's Rule of Five, F1717-0005 has 2 hydrogen bond donor(s) and 4 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 F1717-0005?
The CAS number of F1717-0005 is 714233-02-0.
What is the molecular formula of F1717-0005?
The molecular formula of F1717-0005 is C21H20ClN5O2.
What is the molecular weight of F1717-0005?
The molecular weight of F1717-0005 is 409.13 g/mol.
Where can I buy F1717-0005?
You can request a quote for F1717-0005 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1717-0005?
Yes, KEHONG BIO provides custom synthesis services for F1717-0005 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.