6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione
TL;DR: 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione (CAS 71123-13-2) is a chemical compound with molecular formula C8H12N4O3 and molecular weight 212.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-butoxy-5-diazo-1,3-diazinane-2,4-dione
Also Known As: 6-Butoxy-5-diazo-1,3-diazinane-2,4-dione, 4-butoxy-5-diazonio-2-oxo-3,4-dihydro-1H-pyrimidin-6-olate, 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione, 6-butoxy-5-diazonio-2-oxo-3,6-dihydro-1H-pyrimidin-4-olate
| Molecular Formula | C8H12N4O3 |
|---|---|
| Molecular Weight | 212.09 g/mol |
| LogP | -0.3606 |
| Topological Polar Surface Area | 103.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.09094 |
| Heavy Atoms | 15 |
| Complexity | 321.84848 |
Chemical Identifiers
| CAS Number | 71123-13-2 |
|---|---|
| SMILES | CCCCOC1C(=[N+]=[N-])C(=O)NC(=O)N1 |
Product Overview
6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione (CAS 71123-13-2), with molecular formula C8H12N4O3 and molecular weight 212.09 g/mol. IUPAC: 6-butoxy-5-diazo-1,3-diazinane-2,4-dione.
Chemical Property Profile of 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione
Property Insights of 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione
The XLogP value of -0.3606 indicates that 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione. Following Lipinski's Rule of Five, 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione has 2 hydrogen bond donor(s) and 3 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 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione?
The CAS number of 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione is 71123-13-2.
What is the molecular formula of 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione?
The molecular formula of 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione is C8H12N4O3.
What is the molecular weight of 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione?
The molecular weight of 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione is 212.09 g/mol.
Where can I buy 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione?
You can request a quote for 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione?
Yes, KEHONG BIO provides custom synthesis services for 6-Butoxy-5-diazodihydro-2,4(1H,3H)-pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.