(E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide
TL;DR: (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide (CAS 498570-68-6) is a chemical compound with molecular formula C29H30N6O3S and molecular weight 542.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]acetamide
Also Known As: (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide, 2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]acetamide, 2-{[5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(9-ethyl-9H-carbazol-3-yl)methylidene]acetohydrazide, N-[(1E)-2-(9-ethylcarbazol-3-yl)-1-azavinyl]-2-[5-(3,4-dimethoxyphenyl)-4-ethy l(1,2,4-triazol-3-ylthio)]acetamide
| Molecular Formula | C29H30N6O3S |
|---|---|
| Molecular Weight | 542.21 g/mol |
| LogP | 5.3524 |
| Topological Polar Surface Area | 95.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 542.21 |
| Heavy Atoms | 39 |
| Complexity | 1672.9504 |
Chemical Identifiers
| CAS Number | 498570-68-6 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)/C=N/NC(=O)CSC3=NN=C(N3CC)C4=CC(=C(C=C4)OC)OC)C5=CC=CC=C51 |
Product Overview
(E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide (CAS 498570-68-6), with molecular formula C29H30N6O3S and molecular weight 542.21 g/mol. IUPAC: 2-[[5-(3,4-dimethoxyphenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]acetamide.
Chemical Property Profile of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide
Property Insights of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide
The XLogP value of 5.3524 indicates that (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.56 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide?
The CAS number of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide is 498570-68-6.
What is the molecular formula of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide?
The molecular formula of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide is C29H30N6O3S.
What is the molecular weight of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide?
The molecular weight of (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide is 542.21 g/mol.
Where can I buy (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide?
You can request a quote for (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-((5-(3,4-dimethoxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl)thio)-N'-((9-ethyl-9H-carbazol-3-yl)methylene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.