![1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one structure](/static/products/461/461649-35-4.png)
1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
TL;DR: 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one (CAS 461649-35-4) is a chemical compound with molecular formula C21H17Cl2N3O and molecular weight 397.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
Also Known As: 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one, 3-(2,6-dichlorophenyl)-2-(naphthalen-1-yl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one, 3-(2,6-dichlorophenyl)-2-(naphthalen-1-yl)tetrahydropyrazolo[1,2-a][1,2,4]triazol-1(5H)-one
| Molecular Formula | C21H17Cl2N3O |
|---|---|
| Molecular Weight | 397.07 g/mol |
| LogP | 5.7081 |
| Topological Polar Surface Area | 26.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 397.07486 |
| Heavy Atoms | 27 |
| Complexity | 1029.0311 |
Chemical Identifiers
| CAS Number | 461649-35-4 |
|---|---|
| SMILES | C1CN2C(N(C(=O)N2C1)C3=CC=CC4=CC=CC=C43)C5=C(C=CC=C5Cl)Cl |
Product Overview
1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one (CAS 461649-35-4), with molecular formula C21H17Cl2N3O and molecular weight 397.07 g/mol. IUPAC: 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one.
Chemical Property Profile of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
Property Insights of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
The XLogP value of 5.7081 indicates that 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.79 Ų, 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one?
The CAS number of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one is 461649-35-4.
What is the molecular formula of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one?
The molecular formula of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one is C21H17Cl2N3O.
What is the molecular weight of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one?
The molecular weight of 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one is 397.07 g/mol.
Where can I buy 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one?
You can request a quote for 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-dichlorophenyl)-2-naphthalen-1-yl-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.