![1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione structure](/static/products/879/879470-31-2.png)
1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione
TL;DR: 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione (CAS 879470-31-2) is a chemical compound with molecular formula C22H22N4O5 and molecular weight 422.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1'-methyl-6'-nitro-2'-phenyl-1-propylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione
Also Known As: 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione, 1'-methyl-6'-nitro-2'-phenyl-1-propyl-spiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione, 1'-methyl-6'-nitro-2'-phenyl-1-propylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione, 6-hydroxy-1'-methyl-6'-nitro-2'-phenyl-3-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4(3H)-dione
| Molecular Formula | C22H22N4O5 |
|---|---|
| Molecular Weight | 422.16 g/mol |
| LogP | 2.8032 |
| Topological Polar Surface Area | 112.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 422.15903 |
| Heavy Atoms | 31 |
| Complexity | 1086.5637 |
Chemical Identifiers
| CAS Number | 879470-31-2 |
|---|---|
| SMILES | CCCN1C(=O)C2(CC3=C(C=CC(=C3)[N+](=O)[O-])N(C2C4=CC=CC=C4)C)C(=O)NC1=O |
Product Overview
1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione (CAS 879470-31-2), with molecular formula C22H22N4O5 and molecular weight 422.16 g/mol. IUPAC: 1'-methyl-6'-nitro-2'-phenyl-1-propylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione.
Chemical Property Profile of 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione
Property Insights of 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione
The XLogP value of 2.8032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione. The TPSA of 112.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione. Following Lipinski's Rule of Five, 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione has 1 hydrogen bond donor(s) and 6 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'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
The CAS number of 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione is 879470-31-2.
What is the molecular formula of 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
The molecular formula of 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione is C22H22N4O5.
What is the molecular weight of 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
The molecular weight of 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione is 422.16 g/mol.
Where can I buy 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
You can request a quote for 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 1'-methyl-6'-nitro-2'-phenyl-1-propyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.