![1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one structure](/static/products/879/879464-50-3.png)
1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
TL;DR: 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one (CAS 879464-50-3) is a chemical compound with molecular formula C16H18N4O7 and molecular weight 378.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-(2,2-dimethoxyethyl)-6'-nitrospiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione
Also Known As: 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one, 1'-(2,2-dimethoxyethyl)-6'-nitro-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione, 1'-(2,2-dimethoxyethyl)-6'-nitro-spiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione, 1'-(2,2-dimethoxyethyl)-6'-nitrospiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione
| Molecular Formula | C16H18N4O7 |
|---|---|
| Molecular Weight | 378.12 g/mol |
| LogP | -0.0714 |
| Topological Polar Surface Area | 140.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.11755 |
| Heavy Atoms | 27 |
| Complexity | 800.9869 |
Chemical Identifiers
| CAS Number | 879464-50-3 |
|---|---|
| SMILES | COC(CN1CC2(CC3=C1C=CC(=C3)[N+](=O)[O-])C(=O)NC(=O)NC2=O)OC |
Product Overview
1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one (CAS 879464-50-3), with molecular formula C16H18N4O7 and molecular weight 378.12 g/mol. IUPAC: 1'-(2,2-dimethoxyethyl)-6'-nitrospiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione.
Chemical Property Profile of 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
Property Insights of 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one
The XLogP value of -0.0714 indicates that 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.11 Ų indicates high polarity, suggesting 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one has 2 hydrogen bond donor(s) and 8 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'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one?
The CAS number of 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one is 879464-50-3.
What is the molecular formula of 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one?
The molecular formula of 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one is C16H18N4O7.
What is the molecular weight of 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one?
The molecular weight of 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one is 378.12 g/mol.
Where can I buy 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one?
You can request a quote for 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one?
Yes, KEHONG BIO provides custom synthesis services for 1'-(2,2-dimethoxyethyl)-2,6-dihydroxy-6'-nitro-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinolin]-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.