A3563/0151142
TL;DR: A3563/0151142 (CAS 696602-58-1) is a chemical compound with molecular formula C18H17Cl2N3O2 and molecular weight 377.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenyl)-1-(3-methoxyphenyl)-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one
Also Known As: A3563/0151142, 2-(3,4-dichlorophenyl)-3-(3-methoxyphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-one, 2-(3,4-dichlorophenyl)-1-(3-methoxyphenyl)-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one, 2-(3,4-dichlorophenyl)-3-(3-methoxyphenyl)tetrahydropyrazolo[1,2-a][1,2,4]triazol-1(5H)-one
| Molecular Formula | C18H17Cl2N3O2 |
|---|---|
| Molecular Weight | 377.07 g/mol |
| LogP | 4.5635 |
| Topological Polar Surface Area | 36.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.0698 |
| Heavy Atoms | 25 |
| Complexity | 829.7185 |
Chemical Identifiers
| CAS Number | 696602-58-1 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2N3CCCN3C(=O)N2C4=CC(=C(C=C4)Cl)Cl |
Product Overview
A3563/0151142 (CAS 696602-58-1), with molecular formula C18H17Cl2N3O2 and molecular weight 377.07 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-1-(3-methoxyphenyl)-1,5,6,7-tetrahydropyrazolo[1,2-a][1,2,4]triazol-3-one.
Chemical Property Profile of A3563/0151142
Property Insights of A3563/0151142
The XLogP value of 4.5635 indicates that A3563/0151142 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.02 Ų, A3563/0151142 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3563/0151142 has 0 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 A3563/0151142?
The CAS number of A3563/0151142 is 696602-58-1.
What is the molecular formula of A3563/0151142?
The molecular formula of A3563/0151142 is C18H17Cl2N3O2.
What is the molecular weight of A3563/0151142?
The molecular weight of A3563/0151142 is 377.07 g/mol.
Where can I buy A3563/0151142?
You can request a quote for A3563/0151142 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3563/0151142?
Yes, KEHONG BIO provides custom synthesis services for A3563/0151142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.