8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione
TL;DR: 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione (CAS 902314-82-3) is a chemical compound with molecular formula C30H33N5O4 and molecular weight 527.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione
Also Known As: 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione, 8-(2,5-dimethyl-1H-pyrrol-1-yl)-3-(2-methoxyphenyl)-1',3'-dimethyl-1,2,3,4,4a,6-hexahydro-1'H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(3'H)-trione, 8-(2,5-dimethyl-1H-pyrrol-1-yl)-3-(2-methoxyphenyl)-1',3'-dimethyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
| Molecular Formula | C30H33N5O4 |
|---|---|
| Molecular Weight | 527.25 g/mol |
| LogP | 3.39084 |
| Topological Polar Surface Area | 78.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 527.25323 |
| Heavy Atoms | 39 |
| Complexity | 1467.2115 |
Chemical Identifiers
| CAS Number | 902314-82-3 |
|---|---|
| SMILES | CC1=CC=C(N1C2=CC3=C(C=C2)N4CCN(CC4C5(C3)C(=O)N(C(=O)N(C5=O)C)C)C6=CC=CC=C6OC)C |
Product Overview
8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione (CAS 902314-82-3), with molecular formula C30H33N5O4 and molecular weight 527.25 g/mol. IUPAC: 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione.
Chemical Property Profile of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione
Property Insights of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione
The XLogP value of 3.39084 indicates that 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione. Following Lipinski's Rule of Five, 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione?
The CAS number of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione is 902314-82-3.
What is the molecular formula of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione?
The molecular formula of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione is C30H33N5O4.
What is the molecular weight of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione?
The molecular weight of 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione is 527.25 g/mol.
Where can I buy 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione?
You can request a quote for 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 8'-(2,5-dimethylpyrrol-1-yl)-3'-(2-methoxyphenyl)-1,3-dimethylspiro[1,3-diazinane-5,5'-2,4,4a,6-tetrahydro-1H-pyrazino[1,2-a]quinoline]-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.