5-Nitro-1,4-dihydropyrimidin-6-ol
TL;DR: 5-Nitro-1,4-dihydropyrimidin-6-ol (CAS 282101-99-9) is a chemical compound with molecular formula C4H5N3O3 and molecular weight 143.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitro-1,4-dihydropyrimidin-6-ol
Also Known As: 4-Pyrimidinol,1,6-dihydro-5-nitro-, 5-nitro-1,4-dihydropyrimidin-6-ol, 5-nitro-3,6-dihydropyrimidin-4-ol, 4-Pyrimidinol, 1,6-dihydro-5-nitro- (9CI)
| Molecular Formula | C4H5N3O3 |
|---|---|
| Molecular Weight | 143.03 g/mol |
| LogP | -0.3783 |
| Topological Polar Surface Area | 87.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.0331 |
| Heavy Atoms | 10 |
| Complexity | 219.7877 |
Chemical Identifiers
| CAS Number | 282101-99-9 |
|---|---|
| SMILES | C1C(=C(NC=N1)O)[N+](=O)[O-] |
Product Overview
5-Nitro-1,4-dihydropyrimidin-6-ol (CAS 282101-99-9), with molecular formula C4H5N3O3 and molecular weight 143.03 g/mol. IUPAC: 5-nitro-1,4-dihydropyrimidin-6-ol.
Chemical Property Profile of 5-Nitro-1,4-dihydropyrimidin-6-ol
Property Insights of 5-Nitro-1,4-dihydropyrimidin-6-ol
The XLogP value of -0.3783 indicates that 5-Nitro-1,4-dihydropyrimidin-6-ol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-1,4-dihydropyrimidin-6-ol. Following Lipinski's Rule of Five, 5-Nitro-1,4-dihydropyrimidin-6-ol has 2 hydrogen bond donor(s) and 5 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 5-Nitro-1,4-dihydropyrimidin-6-ol?
The CAS number of 5-Nitro-1,4-dihydropyrimidin-6-ol is 282101-99-9.
What is the molecular formula of 5-Nitro-1,4-dihydropyrimidin-6-ol?
The molecular formula of 5-Nitro-1,4-dihydropyrimidin-6-ol is C4H5N3O3.
What is the molecular weight of 5-Nitro-1,4-dihydropyrimidin-6-ol?
The molecular weight of 5-Nitro-1,4-dihydropyrimidin-6-ol is 143.03 g/mol.
Where can I buy 5-Nitro-1,4-dihydropyrimidin-6-ol?
You can request a quote for 5-Nitro-1,4-dihydropyrimidin-6-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-1,4-dihydropyrimidin-6-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-1,4-dihydropyrimidin-6-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.