![Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate structure](/static/products/3413/3413-78-3.webp)
Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate
TL;DR: Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate (CAS 3413-78-3) is a chemical compound with molecular formula C8H12N6O3 and molecular weight 240.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(5-carbamoyl-1H-imidazol-4-yl)amino]diazenyl]acetate
Also Known As: ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate, Ethyl [3-(5-carbamoyl-4H-imidazol-4-ylidene)triazan-1-yl]acetate, [3-(5-carbamoyl-1(3)H-imidazole-4-yl)-triazenyl]-acetic acid ethyl ester, Acetic acid, [3-(4-carbamoylimidazol-5-yl)-2-triazeno]-, ethyl ester, ethyl 2-[2-[(E)-(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate
| Molecular Formula | C8H12N6O3 |
|---|---|
| Molecular Weight | 240.10 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 240.09709 |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 3413-78-3 |
|---|---|
| SMILES | CCOC(=O)CN=NNC1=C(NC=N1)C(=O)N |
| InChIKey | TXNGTDMYUCCJRY-UHFFFAOYSA-N |
Product Overview
Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate (CAS 3413-78-3), with molecular formula C8H12N6O3 and molecular weight 240.10 g/mol. IUPAC: ethyl 2-[[(5-carbamoyl-1H-imidazol-4-yl)amino]diazenyl]acetate.
Chemical Property Profile of Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate
Property Insights of Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate. Following Lipinski's Rule of Five, Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate has 3 hydrogen bond donor(s) and 7 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-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate?
The CAS number of Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate is 3413-78-3.
What is the molecular formula of Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate?
The molecular formula of Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate is C8H12N6O3.
What is the molecular weight of Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate?
The molecular weight of Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate is 240.10 g/mol.
Where can I buy Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate?
You can request a quote for Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[2-[(5-carbamoylimidazol-4-ylidene)amino]hydrazinyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.