![Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate structure](/static/products/852/85290-79-5.png)
Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate
TL;DR: Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate (CAS 85290-79-5) is a chemical compound with molecular formula C15H17N3O2 and molecular weight 271.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(benzylideneamino)-methylamino]-2-cyanobut-2-enoate
Also Known As: Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate, ethyl 3-[(benzylideneamino)-methylamino]-2-cyanobut-2-enoate, Ethyl 3-(2-benzylidene-1-methylhydrazinyl)-2-cyanobut-2-enoate
| Molecular Formula | C15H17N3O2 |
|---|---|
| Molecular Weight | 271.13 g/mol |
| LogP | 2.31298 |
| Topological Polar Surface Area | 65.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.13208 |
| Heavy Atoms | 20 |
| Complexity | 556.2314 |
Chemical Identifiers
| CAS Number | 85290-79-5 |
|---|---|
| SMILES | CCOC(=O)C(=C(C)N(C)N=CC1=CC=CC=C1)C#N |
Product Overview
Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate (CAS 85290-79-5), with molecular formula C15H17N3O2 and molecular weight 271.13 g/mol. IUPAC: ethyl 3-[(benzylideneamino)-methylamino]-2-cyanobut-2-enoate.
Chemical Property Profile of Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate
Property Insights of Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate
The XLogP value of 2.31298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate. The TPSA of 65.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate. Following Lipinski's Rule of Five, Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate has 0 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 Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate?
The CAS number of Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate is 85290-79-5.
What is the molecular formula of Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate?
The molecular formula of Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate is C15H17N3O2.
What is the molecular weight of Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate?
The molecular weight of Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate is 271.13 g/mol.
Where can I buy Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate?
You can request a quote for Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-cyano-3-[1-methyl-2-(phenylmethylene)hydrazinyl]-2-butenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.