(E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide
TL;DR: (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide (CAS 1005841-92-8) is a chemical compound with molecular formula C19H22N6O4S2 and molecular weight 462.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide
Also Known As: (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide, N'-[(E)-{3-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene]-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide, N-[(E)-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide
| Molecular Formula | C19H22N6O4S2 |
|---|---|
| Molecular Weight | 462.11 g/mol |
| LogP | 2.90304 |
| Topological Polar Surface Area | 124.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 462.1144 |
| Heavy Atoms | 31 |
| Complexity | 1050.2593 |
Chemical Identifiers
| CAS Number | 1005841-92-8 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)N/N=C/C2=CC(=C(C=C2)OC)CSC3=NCCS3)C)[N+](=O)[O-] |
Product Overview
(E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide (CAS 1005841-92-8), with molecular formula C19H22N6O4S2 and molecular weight 462.11 g/mol. IUPAC: N-[(E)-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide.
Chemical Property Profile of (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide
Property Insights of (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide
The XLogP value of 2.90304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide. The TPSA of 124.01 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide. Following Lipinski's Rule of Five, (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide has 1 hydrogen bond donor(s) and 9 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 (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide?
The CAS number of (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide is 1005841-92-8.
What is the molecular formula of (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide?
The molecular formula of (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide is C19H22N6O4S2.
What is the molecular weight of (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide?
The molecular weight of (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide is 462.11 g/mol.
Where can I buy (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide?
You can request a quote for (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N'-(3-(((4,5-dihydrothiazol-2-yl)thio)methyl)-4-methoxybenzylidene)-2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.