1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 56353-70-9) is a chemical compound with molecular formula C25H36N2O7 and molecular weight 476.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,3-bis(butoxymethyl)-2,4,6-trioxo-5-(1-phenylethyl)-1,3-diazinan-5-yl] propanoate
Also Known As: 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-, 1,3-Bis(butoxymethyl)-2,4,6-trioxo-5-(1-phenylethyl)-1,3-diazinan-5-yl propanoate, [1,3-bis(butoxymethyl)-2,4,6-trioxo-5-(1-phenylethyl)-1,3-diazinan-5-yl] propanoate, RefChem:1052728
| Molecular Formula | C25H36N2O7 |
|---|---|
| Molecular Weight | 476.25 g/mol |
| LogP | 3.8213 |
| Topological Polar Surface Area | 102.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 476.25226 |
| Heavy Atoms | 34 |
| Complexity | 808.9257 |
Chemical Identifiers
| CAS Number | 56353-70-9 |
|---|---|
| SMILES | CCCCOCN1C(=O)C(C(=O)N(C1=O)COCCCC)(C(C)C2=CC=CC=C2)OC(=O)CC |
Product Overview
1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 56353-70-9), with molecular formula C25H36N2O7 and molecular weight 476.25 g/mol. IUPAC: [1,3-bis(butoxymethyl)-2,4,6-trioxo-5-(1-phenylethyl)-1,3-diazinan-5-yl] propanoate.
Chemical Property Profile of 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of 3.8213 indicates that 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione. Following Lipinski's Rule of Five, 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione 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 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione is 56353-70-9.
What is the molecular formula of 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione is C25H36N2O7.
What is the molecular weight of 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione is 476.25 g/mol.
Where can I buy 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(butoxymethyl)-5-(1-oxopropoxy)-5-(1-phenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.