F2599-0046
TL;DR: F2599-0046 (CAS 897453-56-4) is a chemical compound with molecular formula C18H21N5O3S and molecular weight 387.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-phenylethyl)-2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide
Also Known As: F2599-0046, N-phenethyl-2-((1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)thio)acetamide, N-(2-phenylethyl)-2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide, N-(2-phenylethyl)-2-[(1,3,9-trimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide, N-phenethyl-2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide
| Molecular Formula | C18H21N5O3S |
|---|---|
| Molecular Weight | 387.14 g/mol |
| LogP | 0.4217 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.1365 |
| Heavy Atoms | 27 |
| Complexity | 1098.113 |
Chemical Identifiers
| CAS Number | 897453-56-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1SCC(=O)NCCC3=CC=CC=C3 |
Product Overview
F2599-0046 (CAS 897453-56-4), with molecular formula C18H21N5O3S and molecular weight 387.14 g/mol. IUPAC: N-(2-phenylethyl)-2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide.
Chemical Property Profile of F2599-0046
Property Insights of F2599-0046
The XLogP value of 0.4217 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2599-0046. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for F2599-0046. Following Lipinski's Rule of Five, F2599-0046 has 1 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 F2599-0046?
The CAS number of F2599-0046 is 897453-56-4.
What is the molecular formula of F2599-0046?
The molecular formula of F2599-0046 is C18H21N5O3S.
What is the molecular weight of F2599-0046?
The molecular weight of F2599-0046 is 387.14 g/mol.
Where can I buy F2599-0046?
You can request a quote for F2599-0046 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2599-0046?
Yes, KEHONG BIO provides custom synthesis services for F2599-0046 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.