![1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione structure](/static/products/879/879458-35-2.png)
1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione
TL;DR: 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione (CAS 879458-35-2) is a chemical compound with molecular formula C25H27N3O3 and molecular weight 417.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(cyclohexen-1-yl)ethyl]-4'-methylspiro[1,3-diazinane-5,2'-1,3-dihydrobenzo[f]quinoline]-2,4,6-trione
Also Known As: 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione, 1-[2-(cyclohexen-1-yl)ethyl]-4'-methylspiro[1,3-diazinane-5,2'-1,3-dihydrobenzo[f]quinoline]-2,4,6-trione, 3'-[2-(cyclohex-1-en-1-yl)ethyl]-6'-hydroxy-4-methyl-3,4-dihydro-1H,2'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4'(3'H)-dione
| Molecular Formula | C25H27N3O3 |
|---|---|
| Molecular Weight | 417.21 g/mol |
| LogP | 3.7874 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 417.20523 |
| Heavy Atoms | 31 |
| Complexity | 1122.1925 |
Chemical Identifiers
| CAS Number | 879458-35-2 |
|---|---|
| SMILES | CN1CC2(CC3=C1C=CC4=CC=CC=C34)C(=O)NC(=O)N(C2=O)CCC5=CCCCC5 |
Product Overview
1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione (CAS 879458-35-2), with molecular formula C25H27N3O3 and molecular weight 417.21 g/mol. IUPAC: 1-[2-(cyclohexen-1-yl)ethyl]-4'-methylspiro[1,3-diazinane-5,2'-1,3-dihydrobenzo[f]quinoline]-2,4,6-trione.
Chemical Property Profile of 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione
Property Insights of 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione
The XLogP value of 3.7874 indicates that 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione. Following Lipinski's Rule of Five, 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-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'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione?
The CAS number of 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione is 879458-35-2.
What is the molecular formula of 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione?
The molecular formula of 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione is C25H27N3O3.
What is the molecular weight of 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione?
The molecular weight of 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione is 417.21 g/mol.
Where can I buy 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione?
You can request a quote for 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 1'-(2-(cyclohex-1-en-1-yl)ethyl)-4-methyl-3,4-dihydro-1H,1'H-spiro[benzo[f]quinoline-2,5'-pyrimidine]-2',4',6'(3'H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.