ChemDiv2_004142
TL;DR: ChemDiv2_004142 (CAS 333755-49-0) is a chemical compound with molecular formula C19H25N5O5 and molecular weight 403.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(dimethylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethylpurine-2,6-dione
Also Known As: ChemDiv2_004142, BAS 02999203, IDI1_002857, AB01286982-01, 8-(dimethylamino)-7-(2-hydroxy-3-(4-methoxyphenoxy)propyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C19H25N5O5 |
|---|---|
| Molecular Weight | 403.19 g/mol |
| LogP | -0.0518 |
| Topological Polar Surface Area | 103.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.18558 |
| Heavy Atoms | 29 |
| Complexity | 1127.073 |
Chemical Identifiers
| CAS Number | 333755-49-0 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N(C)C)CC(COC3=CC=C(C=C3)OC)O |
Product Overview
ChemDiv2_004142 (CAS 333755-49-0), with molecular formula C19H25N5O5 and molecular weight 403.19 g/mol. IUPAC: 8-(dimethylamino)-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of ChemDiv2_004142
Property Insights of ChemDiv2_004142
The XLogP value of -0.0518 indicates that ChemDiv2_004142 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_004142. Following Lipinski's Rule of Five, ChemDiv2_004142 has 1 hydrogen bond donor(s) and 7 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 ChemDiv2_004142?
The CAS number of ChemDiv2_004142 is 333755-49-0.
What is the molecular formula of ChemDiv2_004142?
The molecular formula of ChemDiv2_004142 is C19H25N5O5.
What is the molecular weight of ChemDiv2_004142?
The molecular weight of ChemDiv2_004142 is 403.19 g/mol.
Where can I buy ChemDiv2_004142?
You can request a quote for ChemDiv2_004142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_004142?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_004142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.