2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
TL;DR: 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide (CAS 845901-52-2) is a chemical compound with molecular formula C28H29N5O3 and molecular weight 483.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-N-[5-(4-methylphenyl)-7-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide
Also Known As: 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide, 2-(3,4-dimethoxyphenyl)-N-[5-(4-methylphenyl)-7-phenyl-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide, 2-(3,4-dimethoxyphenyl)-N-[5-(4-methylphenyl)-7-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide
| Molecular Formula | C28H29N5O3 |
|---|---|
| Molecular Weight | 483.23 g/mol |
| LogP | 4.93122 |
| Topological Polar Surface Area | 90.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 483.22705 |
| Heavy Atoms | 36 |
| Complexity | 1351.6251 |
Chemical Identifiers
| CAS Number | 845901-52-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2CC(N3C(=NC(=N3)NC(=O)CC4=CC(=C(C=C4)OC)OC)N2)C5=CC=CC=C5 |
Product Overview
2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide (CAS 845901-52-2), with molecular formula C28H29N5O3 and molecular weight 483.23 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-N-[5-(4-methylphenyl)-7-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]acetamide.
Chemical Property Profile of 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
Property Insights of 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide
The XLogP value of 4.93122 indicates that 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide. Following Lipinski's Rule of Five, 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide has 2 hydrogen bond donor(s) and 6 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 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide?
The CAS number of 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide is 845901-52-2.
What is the molecular formula of 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide?
The molecular formula of 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide is C28H29N5O3.
What is the molecular weight of 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide?
The molecular weight of 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide is 483.23 g/mol.
Where can I buy 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide?
You can request a quote for 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-dimethoxyphenyl)-N-(7-phenyl-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.