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2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
TL;DR: 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one (CAS 116293-85-7) is a chemical compound with molecular formula C18H14N4O and molecular weight 302.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
Also Known As: 2-benzyl-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one, 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one, [1,2,4]Triazolo[1,5-a]pyrimidin-7-ol, 5-phenyl-2-(phenylmethyl)-, 2-BENZYL-5-PHENYL-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-7-OL, 2-Benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one
| Molecular Formula | C18H14N4O |
|---|---|
| Molecular Weight | 302.12 g/mol |
| LogP | 2.6754 |
| Topological Polar Surface Area | 63.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.11676 |
| Heavy Atoms | 23 |
| Complexity | 1003.56836 |
Chemical Identifiers
| CAS Number | 116293-85-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NC3=NC(=CC(=O)N3N2)C4=CC=CC=C4 |
Product Overview
2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one (CAS 116293-85-7), with molecular formula C18H14N4O and molecular weight 302.12 g/mol. IUPAC: 2-benzyl-5-phenyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one.
Chemical Property Profile of 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Property Insights of 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
The XLogP value of 2.6754 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one. The TPSA of 63.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one. Following Lipinski's Rule of Five, 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one has 1 hydrogen bond donor(s) and 3 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-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
The CAS number of 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one is 116293-85-7.
What is the molecular formula of 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular formula of 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one is C18H14N4O.
What is the molecular weight of 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
The molecular weight of 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one is 302.12 g/mol.
Where can I buy 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
You can request a quote for 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-benzyl-5-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.