11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol
TL;DR: 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol (CAS 489466-33-3) is a chemical compound with molecular formula C29H27N5O and molecular weight 461.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(4-tert-butylphenyl)-15-methyl-13-phenyl-1,8,11,13,14-pentazatetracyclo[8.7.0.02,7.012,16]heptadeca-2,4,6,10,12(16),14-hexaen-9-one
Also Known As: 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol, 11-(4-tert-butylphenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol
| Molecular Formula | C29H27N5O |
|---|---|
| Molecular Weight | 461.22 g/mol |
| LogP | 6.06992 |
| Topological Polar Surface Area | 62.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 461.22156 |
| Heavy Atoms | 35 |
| Complexity | 1475.9985 |
Chemical Identifiers
| CAS Number | 489466-33-3 |
|---|---|
| SMILES | CC1=NN(C2=C1C(N3C4=CC=CC=C4NC(=O)C3=N2)C5=CC=C(C=C5)C(C)(C)C)C6=CC=CC=C6 |
Product Overview
11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol (CAS 489466-33-3), with molecular formula C29H27N5O and molecular weight 461.22 g/mol. IUPAC: 17-(4-tert-butylphenyl)-15-methyl-13-phenyl-1,8,11,13,14-pentazatetracyclo[8.7.0.02,7.012,16]heptadeca-2,4,6,10,12(16),14-hexaen-9-one.
Chemical Property Profile of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol
Property Insights of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol
The XLogP value of 6.06992 indicates that 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol. Following Lipinski's Rule of Five, 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol?
The CAS number of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol is 489466-33-3.
What is the molecular formula of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol?
The molecular formula of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol is C29H27N5O.
What is the molecular weight of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol?
The molecular weight of 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol is 461.22 g/mol.
Where can I buy 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol?
You can request a quote for 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol?
Yes, KEHONG BIO provides custom synthesis services for 11-(4-(tert-butyl)phenyl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.