4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide
TL;DR: 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide (CAS 765286-89-3) is a chemical compound with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3,4-dimethoxyphenyl)methylideneamino]-3-pyridin-2-yl-1,4-dihydropyrazole-5-thione
Also Known As: 4-((3,4-Dimethoxybenzylidene)amino)-5-(pyridin-2-yl)-4H-pyrazole-3-thiol, 4-((3,4-DIMETHOXYBENZYLIDENE)AMINO)-5-(2-PYRIDINYL)-4H-PYRAZOL-3-YL HYDROSULFIDE, 4-[(3,4-dimethoxyphenyl)methylideneamino]-3-pyridin-2-yl-1,4-dihydropyrazole-5-thione, 4-[(3,4-dimethoxyphenyl)methylideneamino]-5-pyridin-2-yl-2,4-dihydropyrazole-3-thione, 644-029-2
| Molecular Formula | C17H16N4O2S |
|---|---|
| Molecular Weight | 340.10 g/mol |
| LogP | 2.2212 |
| Topological Polar Surface Area | 68.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.0994 |
| Heavy Atoms | 24 |
| Complexity | 805.4928 |
Chemical Identifiers
| CAS Number | 765286-89-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=NC2C(=NNC2=S)C3=CC=CC=N3)OC |
Product Overview
4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide (CAS 765286-89-3), with molecular formula C17H16N4O2S and molecular weight 340.10 g/mol. IUPAC: 4-[(3,4-dimethoxyphenyl)methylideneamino]-3-pyridin-2-yl-1,4-dihydropyrazole-5-thione.
Chemical Property Profile of 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide
Property Insights of 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide
The XLogP value of 2.2212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide. The TPSA of 68.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide. Following Lipinski's Rule of Five, 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide 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 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide?
The CAS number of 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide is 765286-89-3.
What is the molecular formula of 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide?
The molecular formula of 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide is C17H16N4O2S.
What is the molecular weight of 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide?
The molecular weight of 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide is 340.10 g/mol.
Where can I buy 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide?
You can request a quote for 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-((3,4-Dimethoxybenzylidene)amino)-5-(2-pyridinyl)-4H-pyrazol-3-YL hydrosulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.