Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate
TL;DR: Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate (CAS 26154-44-9) is a chemical compound with molecular formula C12H21N3O6 and molecular weight 303.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate
Also Known As: ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate, ethyl (Z)-3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate, Diethyl 1-(3-amino-1-ethoxy-1-oxobut-2-en-2-yl)hydrazine-1,2-dicarboxylate, 1,2-Hydrazinedicarboxylicacid, 1-[2-amino-1-(ethoxycarbonyl)-1-propen-1-yl]-, 1,2-diethyl ester
| Molecular Formula | C12H21N3O6 |
|---|---|
| Molecular Weight | 303.14 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 303.14304 |
| Heavy Atoms | 21 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 26154-44-9 |
|---|---|
| SMILES | CCOC(=O)C(=C(C)N)N(C(=O)OCC)NC(=O)OCC |
| InChIKey | CJCIKNJNLZCPOI-UHFFFAOYSA-N |
Product Overview
Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate (CAS 26154-44-9), with molecular formula C12H21N3O6 and molecular weight 303.14 g/mol. IUPAC: ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate.
Chemical Property Profile of Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate
Property Insights of Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate. Following Lipinski's Rule of Five, Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate has 2 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 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate?
The CAS number of Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate is 26154-44-9.
What is the molecular formula of Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate?
The molecular formula of Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate is C12H21N3O6.
What is the molecular weight of Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate?
The molecular weight of Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate is 303.14 g/mol.
Where can I buy Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate?
You can request a quote for Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-amino-2-[ethoxycarbonyl-(ethoxycarbonylamino)amino]but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.