![Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate structure](/static/products/320/320582-59-0.png)
Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate
TL;DR: Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate (CAS 320582-59-0) is a chemical compound with molecular formula C13H16ClN3O3 and molecular weight 297.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[(E)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]carbamate
Also Known As: ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate, ethyl N-[(E)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]carbamate, (E)-ethyl 2-(4-((2-chlorophenyl)amino)-4-oxobutan-2-ylidene)hydrazinecarboxylate
| Molecular Formula | C13H16ClN3O3 |
|---|---|
| Molecular Weight | 297.09 g/mol |
| LogP | 2.7906 |
| Topological Polar Surface Area | 79.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.088 |
| Heavy Atoms | 20 |
| Complexity | 517.33777 |
Chemical Identifiers
| CAS Number | 320582-59-0 |
|---|---|
| SMILES | CCOC(=O)N/N=C(\C)/CC(=O)NC1=CC=CC=C1Cl |
Product Overview
Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate (CAS 320582-59-0), with molecular formula C13H16ClN3O3 and molecular weight 297.09 g/mol. IUPAC: ethyl N-[(E)-[4-(2-chloroanilino)-4-oxobutan-2-ylidene]amino]carbamate.
Chemical Property Profile of Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate
Property Insights of Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate
The XLogP value of 2.7906 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate. The TPSA of 79.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate. Following Lipinski's Rule of Five, Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate has 2 hydrogen bond donor(s) and 4 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-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate?
The CAS number of Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate is 320582-59-0.
What is the molecular formula of Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate?
The molecular formula of Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate is C13H16ClN3O3.
What is the molecular weight of Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate?
The molecular weight of Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate is 297.09 g/mol.
Where can I buy Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate?
You can request a quote for Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[3-(2-chloroanilino)-1-methyl-3-oxopropylidene]hydrazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.