![methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate structure](/static/products/900/900896-41-5.png)
methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate
TL;DR: methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate (CAS 900896-41-5) is a chemical compound with molecular formula C23H20N4O3 and molecular weight 400.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(8-oxo-6-phenyl-5,6,7,9-tetrahydro-4H-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate
Also Known As: methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate, methyl 4-(8-oxo-6-phenyl-4,5,6,7,8,9-hexahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate, methyl 4-(8-oxo-6-phenyl-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate, methyl 4-(8-oxo-6-phenyl-5,6,7,9-tetrahydro-1H-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate
| Molecular Formula | C23H20N4O3 |
|---|---|
| Molecular Weight | 400.15 g/mol |
| LogP | 3.4804 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.15353 |
| Heavy Atoms | 30 |
| Complexity | 1148.706 |
Chemical Identifiers
| CAS Number | 900896-41-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=NC=NN25 |
Product Overview
methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate (CAS 900896-41-5), with molecular formula C23H20N4O3 and molecular weight 400.15 g/mol. IUPAC: methyl 4-(8-oxo-6-phenyl-5,6,7,9-tetrahydro-4H-[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate.
Chemical Property Profile of methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate
Property Insights of methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate
The XLogP value of 3.4804 indicates that methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate. Following Lipinski's Rule of Five, methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate has 1 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 methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate?
The CAS number of methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate is 900896-41-5.
What is the molecular formula of methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate?
The molecular formula of methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate is C23H20N4O3.
What is the molecular weight of methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate?
The molecular weight of methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate is 400.15 g/mol.
Where can I buy methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate?
You can request a quote for methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(8-hydroxy-6-phenyl-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-9-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.