F1687-0130
TL;DR: F1687-0130 (CAS 78960-51-7) is a chemical compound with molecular formula C22H23N5O4 and molecular weight 421.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-anilino-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione
Also Known As: F1687-0130, 7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-(phenylamino)-1H-purine-2,6(3H,7H)-dione, 8-anilino-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione, 7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-(phenylamino)-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C22H23N5O4 |
|---|---|
| Molecular Weight | 421.18 g/mol |
| LogP | 1.6172 |
| Topological Polar Surface Area | 103.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 421.17502 |
| Heavy Atoms | 31 |
| Complexity | 1309.2317 |
Chemical Identifiers
| CAS Number | 78960-51-7 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NC3=CC=CC=C3)CC(COC4=CC=CC=C4)O |
Product Overview
F1687-0130 (CAS 78960-51-7), with molecular formula C22H23N5O4 and molecular weight 421.18 g/mol. IUPAC: 8-anilino-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of F1687-0130
Property Insights of F1687-0130
The XLogP value of 1.6172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1687-0130. The TPSA of 103.31 Ų falls within the moderate polarity range, balancing permeability and solubility for F1687-0130. Following Lipinski's Rule of Five, F1687-0130 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 F1687-0130?
The CAS number of F1687-0130 is 78960-51-7.
What is the molecular formula of F1687-0130?
The molecular formula of F1687-0130 is C22H23N5O4.
What is the molecular weight of F1687-0130?
The molecular weight of F1687-0130 is 421.18 g/mol.
Where can I buy F1687-0130?
You can request a quote for F1687-0130 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1687-0130?
Yes, KEHONG BIO provides custom synthesis services for F1687-0130 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.