UPCMLD0ENAT5836569:001
TL;DR: UPCMLD0ENAT5836569:001 (CAS 893944-28-0) is a chemical compound with molecular formula C18H26N6O5 and molecular weight 406.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[1,3-dimethyl-2,6-dioxo-7-(2-oxopropyl)purin-8-yl]methyl]piperazine-1-carboxylate
Also Known As: UPCMLD0ENAT5836569:001, Ethyl 4-[[1,3-dimethyl-2,6-dioxo-7-(2-oxopropyl)purin-8-yl]methyl]piperazine-1-carboxylate, ethyl 4-{[1,3-dimethyl-2,6-dioxo-7-(2-oxopropyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperazine-1-carboxylate, ethyl 4-((1,3-dimethyl-2,6-dioxo-7-(2-oxopropyl)-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl)piperazine-1-carboxylate, ethyl 4-{[1,3-dimethyl-2,6-dioxo-7-(2-oxopropyl)-1,3,7-trihydropurin-8-yl]meth yl}piperazinecarboxylate
| Molecular Formula | C18H26N6O5 |
|---|---|
| Molecular Weight | 406.20 g/mol |
| LogP | -0.7032 |
| Topological Polar Surface Area | 111.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.19647 |
| Heavy Atoms | 29 |
| Complexity | 1057.3468 |
Chemical Identifiers
| CAS Number | 893944-28-0 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)CC2=NC3=C(N2CC(=O)C)C(=O)N(C(=O)N3C)C |
Product Overview
UPCMLD0ENAT5836569:001 (CAS 893944-28-0), with molecular formula C18H26N6O5 and molecular weight 406.20 g/mol. IUPAC: ethyl 4-[[1,3-dimethyl-2,6-dioxo-7-(2-oxopropyl)purin-8-yl]methyl]piperazine-1-carboxylate.
Chemical Property Profile of UPCMLD0ENAT5836569:001
Property Insights of UPCMLD0ENAT5836569:001
The XLogP value of -0.7032 indicates that UPCMLD0ENAT5836569:001 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.67 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5836569:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5836569:001 has 0 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 UPCMLD0ENAT5836569:001?
The CAS number of UPCMLD0ENAT5836569:001 is 893944-28-0.
What is the molecular formula of UPCMLD0ENAT5836569:001?
The molecular formula of UPCMLD0ENAT5836569:001 is C18H26N6O5.
What is the molecular weight of UPCMLD0ENAT5836569:001?
The molecular weight of UPCMLD0ENAT5836569:001 is 406.20 g/mol.
Where can I buy UPCMLD0ENAT5836569:001?
You can request a quote for UPCMLD0ENAT5836569:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5836569:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5836569:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.