![N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide structure](/static/products/314/314293-57-7.png)
N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide
TL;DR: N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide (CAS 314293-57-7) is a chemical compound with molecular formula C14H16N6O2S and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)diazenyl]phenyl]-N-methylacetamide
Also Known As: N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide, N-(4-{2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide, N-[4-[(2Z)-2-(1-carbamothioyl-3-methyl-5-oxopyrazol-4-ylidene)hydrazinyl]phenyl]-N-methylacetamide, N-[4-[(1-carbamothioyl-3-methyl-5-oxo-4H-pyrazol-4-yl)azo]phenyl]-N-methylacetamide, N-[4-[(1-carbamothioyl-3-methyl-5-oxo-4H-pyrazol-4-yl)diazenyl]phenyl]-N-methylacetamide
| Molecular Formula | C14H16N6O2S |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 1.97462 |
| Topological Polar Surface Area | 108.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.10553 |
| Heavy Atoms | 23 |
| Complexity | 833.9426 |
Chemical Identifiers
| CAS Number | 314293-57-7 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C(=S)N)N=NC2=CC=C(C=C2)N(C)C(=O)C |
Product Overview
N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide (CAS 314293-57-7), with molecular formula C14H16N6O2S and molecular weight 332.11 g/mol. IUPAC: N-[4-[(2-carbamothioyl-5-methyl-3-oxo-1H-pyrazol-4-yl)diazenyl]phenyl]-N-methylacetamide.
Chemical Property Profile of N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide
Property Insights of N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide
The XLogP value of 1.97462 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide. The TPSA of 108.84 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide. Following Lipinski's Rule of Five, N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide has 2 hydrogen bond donor(s) and 5 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 N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide?
The CAS number of N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide is 314293-57-7.
What is the molecular formula of N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide?
The molecular formula of N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide is C14H16N6O2S.
What is the molecular weight of N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide?
The molecular weight of N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide is 332.11 g/mol.
Where can I buy N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide?
You can request a quote for N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-{(2E)-2-[1-(aminocarbonothioyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-N-methylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.