A3885/0165193
TL;DR: A3885/0165193 (CAS 728882-25-5) is a chemical compound with molecular formula C16H16FN5O3 and molecular weight 345.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-fluorophenyl)methyl]acetamide
Also Known As: A3885/0165193, 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(4-fluorobenzyl)acetamide, 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)-N-[(4-fluorophenyl)methyl]acetamide, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-fluorophenyl)methyl]acetamide
| Molecular Formula | C16H16FN5O3 |
|---|---|
| Molecular Weight | 345.12 g/mol |
| LogP | -0.1108 |
| Topological Polar Surface Area | 90.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.12372 |
| Heavy Atoms | 25 |
| Complexity | 1062.2942 |
Chemical Identifiers
| CAS Number | 728882-25-5 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)NCC3=CC=C(C=C3)F |
Product Overview
A3885/0165193 (CAS 728882-25-5), with molecular formula C16H16FN5O3 and molecular weight 345.12 g/mol. IUPAC: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(4-fluorophenyl)methyl]acetamide.
Chemical Property Profile of A3885/0165193
Property Insights of A3885/0165193
The XLogP value of -0.1108 indicates that A3885/0165193 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.92 Ų falls within the moderate polarity range, balancing permeability and solubility for A3885/0165193. Following Lipinski's Rule of Five, A3885/0165193 has 1 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 A3885/0165193?
The CAS number of A3885/0165193 is 728882-25-5.
What is the molecular formula of A3885/0165193?
The molecular formula of A3885/0165193 is C16H16FN5O3.
What is the molecular weight of A3885/0165193?
The molecular weight of A3885/0165193 is 345.12 g/mol.
Where can I buy A3885/0165193?
You can request a quote for A3885/0165193 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3885/0165193?
Yes, KEHONG BIO provides custom synthesis services for A3885/0165193 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.