1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
TL;DR: 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone (CAS 902303-05-3) is a chemical compound with molecular formula C24H22N4O5 and molecular weight 446.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(3,4-dimethoxyphenyl)methyl]-13-(furan-2-yl)-11-methyl-10-oxa-3,5,6,8-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,11-pentaen-12-yl]ethanone
Also Known As: 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone, 1-(2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl)ethanone
| Molecular Formula | C24H22N4O5 |
|---|---|
| Molecular Weight | 446.16 g/mol |
| LogP | 3.7126 |
| Topological Polar Surface Area | 100.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.15903 |
| Heavy Atoms | 33 |
| Complexity | 1387.6277 |
Chemical Identifiers
| CAS Number | 902303-05-3 |
|---|---|
| SMILES | CC1=C(C(C2=C(O1)N=CN3C2=NC(=N3)CC4=CC(=C(C=C4)OC)OC)C5=CC=CO5)C(=O)C |
Product Overview
1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone (CAS 902303-05-3), with molecular formula C24H22N4O5 and molecular weight 446.16 g/mol. IUPAC: 1-[4-[(3,4-dimethoxyphenyl)methyl]-13-(furan-2-yl)-11-methyl-10-oxa-3,5,6,8-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7,11-pentaen-12-yl]ethanone.
Chemical Property Profile of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
Property Insights of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone
The XLogP value of 3.7126 indicates that 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone. Following Lipinski's Rule of Five, 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone?
The CAS number of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone is 902303-05-3.
What is the molecular formula of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone?
The molecular formula of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone is C24H22N4O5.
What is the molecular weight of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone?
The molecular weight of 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone is 446.16 g/mol.
Where can I buy 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone?
You can request a quote for 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(3,4-dimethoxybenzyl)-10-(furan-2-yl)-8-methyl-10H-pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-yl]ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.