11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
TL;DR: 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine (CAS 846580-82-3) is a chemical compound with molecular formula C31H26N6O3 and molecular weight 530.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-(3,4-dimethoxyphenyl)-14-methyl-4-(2-methylphenyl)-12-phenyl-10-oxa-3,5,6,8,12,13-hexazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2,4,7,11(15),13-hexaene
Also Known As: 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine, 11-(3,4-dimethoxyphenyl)-10-methyl-8-phenyl-2-(o-tolyl)-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C31H26N6O3 |
|---|---|
| Molecular Weight | 530.21 g/mol |
| LogP | 5.89694 |
| Topological Polar Surface Area | 88.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 530.20667 |
| Heavy Atoms | 40 |
| Complexity | 1893.0836 |
Chemical Identifiers
| CAS Number | 846580-82-3 |
|---|---|
| SMILES | CC1=CC=CC=C1C2=NN3C=NC4=C(C3=N2)C(C5=C(O4)N(N=C5C)C6=CC=CC=C6)C7=CC(=C(C=C7)OC)OC |
Product Overview
11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine (CAS 846580-82-3), with molecular formula C31H26N6O3 and molecular weight 530.21 g/mol. IUPAC: 16-(3,4-dimethoxyphenyl)-14-methyl-4-(2-methylphenyl)-12-phenyl-10-oxa-3,5,6,8,12,13-hexazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2,4,7,11(15),13-hexaene.
Chemical Property Profile of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Property Insights of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
The XLogP value of 5.89694 indicates that 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine. Following Lipinski's Rule of Five, 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine?
The CAS number of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine is 846580-82-3.
What is the molecular formula of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine?
The molecular formula of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine is C31H26N6O3.
What is the molecular weight of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine?
The molecular weight of 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine is 530.21 g/mol.
Where can I buy 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine?
You can request a quote for 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 11-(3,4-dimethoxyphenyl)-10-methyl-2-(2-methylphenyl)-8-phenyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.