N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
TL;DR: N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine (CAS 840455-93-8) is a chemical compound with molecular formula C30H22N6O3 and molecular weight 514.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-17-(furan-2-yl)-15-methyl-13-phenyl-1,8,11,13,14-pentazatetracyclo[8.7.0.02,7.012,16]heptadeca-2,4,6,8,10,12(16),14-heptaen-9-amine
Also Known As: N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine, N-(1,3-benzodioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
| Molecular Formula | C30H22N6O3 |
|---|---|
| Molecular Weight | 514.18 g/mol |
| LogP | 6.29772 |
| Topological Polar Surface Area | 89.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 514.17535 |
| Heavy Atoms | 39 |
| Complexity | 1788.968 |
Chemical Identifiers
| CAS Number | 840455-93-8 |
|---|---|
| SMILES | CC1=NN(C2=C1C(N3C4=CC=CC=C4N=C(C3=N2)NC5=CC6=C(C=C5)OCO6)C7=CC=CO7)C8=CC=CC=C8 |
Product Overview
N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine (CAS 840455-93-8), with molecular formula C30H22N6O3 and molecular weight 514.18 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-17-(furan-2-yl)-15-methyl-13-phenyl-1,8,11,13,14-pentazatetracyclo[8.7.0.02,7.012,16]heptadeca-2,4,6,8,10,12(16),14-heptaen-9-amine.
Chemical Property Profile of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Property Insights of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
The XLogP value of 6.29772 indicates that N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.41 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine. Following Lipinski's Rule of Five, N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine?
The CAS number of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine is 840455-93-8.
What is the molecular formula of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine?
The molecular formula of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine is C30H22N6O3.
What is the molecular weight of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine?
The molecular weight of N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine is 514.18 g/mol.
Where can I buy N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine?
You can request a quote for N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(benzo[d][1,3]dioxol-5-yl)-11-(furan-2-yl)-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.