3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol
TL;DR: 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol (CAS 848686-09-9) is a chemical compound with molecular formula C32H26N6O and molecular weight 510.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[9-anilino-15-methyl-13-(4-methylphenyl)-1,8,11,13,14-pentazatetracyclo[8.7.0.02,7.012,16]heptadeca-2,4,6,8,10,12(16),14-heptaen-17-yl]phenol
Also Known As: 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol, 3-[10-methyl-8-(4-methylphenyl)-6-(phenylamino)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl]phenol
| Molecular Formula | C32H26N6O |
|---|---|
| Molecular Weight | 510.22 g/mol |
| LogP | 6.99004 |
| Topological Polar Surface Area | 78.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 510.2168 |
| Heavy Atoms | 39 |
| Complexity | 1768.7101 |
Chemical Identifiers
| CAS Number | 848686-09-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3=C(C(N4C5=CC=CC=C5N=C(C4=N3)NC6=CC=CC=C6)C7=CC(=CC=C7)O)C(=N2)C |
Product Overview
3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol (CAS 848686-09-9), with molecular formula C32H26N6O and molecular weight 510.22 g/mol. IUPAC: 3-[9-anilino-15-methyl-13-(4-methylphenyl)-1,8,11,13,14-pentazatetracyclo[8.7.0.02,7.012,16]heptadeca-2,4,6,8,10,12(16),14-heptaen-17-yl]phenol.
Chemical Property Profile of 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol
Property Insights of 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol
The XLogP value of 6.99004 indicates that 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol. Following Lipinski's Rule of Five, 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol has 2 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 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol?
The CAS number of 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol is 848686-09-9.
What is the molecular formula of 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol?
The molecular formula of 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol is C32H26N6O.
What is the molecular weight of 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol?
The molecular weight of 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol is 510.22 g/mol.
Where can I buy 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol?
You can request a quote for 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-(10-methyl-6-(phenylamino)-8-(p-tolyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.