![ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate structure](/static/products/3384/338410-10-9.webp)
ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate
TL;DR: ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate (CAS 338410-10-9) is a chemical compound with molecular formula C17H18ClF3N6O4 and molecular weight 462.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate
Also Known As: ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate, ethyl N-{3-[2-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino}butanoyl)hydrazono]-2-cyanopropanoyl}carbamate
| Molecular Formula | C17H18ClF3N6O4 |
|---|---|
| Molecular Weight | 462.10 g/mol |
| LogP | 2.46038 |
| Topological Polar Surface Area | 145.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 462.10303 |
| Heavy Atoms | 31 |
| Complexity | 872.4033 |
Chemical Identifiers
| CAS Number | 338410-10-9 |
|---|---|
| SMILES | CCOC(=O)NC(=O)C(C=NNC(=O)CCCNC1=C(C=C(C=N1)C(F)(F)F)Cl)C#N |
Product Overview
ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate (CAS 338410-10-9), with molecular formula C17H18ClF3N6O4 and molecular weight 462.10 g/mol. IUPAC: ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate.
Chemical Property Profile of ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate
Property Insights of ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate
The XLogP value of 2.46038 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate. The TPSA of 145.57 Ų indicates high polarity, suggesting ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate has 3 hydrogen bond donor(s) and 8 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 ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate?
The CAS number of ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate is 338410-10-9.
What is the molecular formula of ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate?
The molecular formula of ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate is C17H18ClF3N6O4.
What is the molecular weight of ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate?
The molecular weight of ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate is 462.10 g/mol.
Where can I buy ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate?
You can request a quote for ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[3-[4-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]butanoylhydrazinylidene]-2-cyanopropanoyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.