![1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione structure](/static/products/877/877803-06-0.png)
1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione
TL;DR: 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione (CAS 877803-06-0) is a chemical compound with molecular formula C22H22FN3O3 and molecular weight 395.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-fluorophenyl)ethyl]-1',6'-dimethylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione
Also Known As: 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione, 1-[2-(4-fluorophenyl)ethyl]-1',6'-dimethylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione
| Molecular Formula | C22H22FN3O3 |
|---|---|
| Molecular Weight | 395.16 g/mol |
| LogP | 2.43392 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 395.16452 |
| Heavy Atoms | 29 |
| Complexity | 1004.8621 |
Chemical Identifiers
| CAS Number | 877803-06-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(CC3(C2)C(=O)NC(=O)N(C3=O)CCC4=CC=C(C=C4)F)C |
Product Overview
1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione (CAS 877803-06-0), with molecular formula C22H22FN3O3 and molecular weight 395.16 g/mol. IUPAC: 1-[2-(4-fluorophenyl)ethyl]-1',6'-dimethylspiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-2,4,6-trione.
Chemical Property Profile of 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione
Property Insights of 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione
The XLogP value of 2.43392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione. Following Lipinski's Rule of Five, 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione has 1 hydrogen bond donor(s) and 4 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-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
The CAS number of 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione is 877803-06-0.
What is the molecular formula of 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
The molecular formula of 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione is C22H22FN3O3.
What is the molecular weight of 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
The molecular weight of 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione is 395.16 g/mol.
Where can I buy 1-(4-fluorophenethyl)-1',6'-dimethyl-2',4'-dihydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(3H)-trione?
You can request a quote for 1-(4-fluorophenethyl)-1',6'-dimethyl-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-(4-fluorophenethyl)-1',6'-dimethyl-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-(4-fluorophenethyl)-1',6'-dimethyl-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.