1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester
TL;DR: 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester (CAS 55081-28-2) is a chemical compound with molecular formula C12H23N3O4 and molecular weight 273.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(ethoxycarbonylamino)ethyl]piperazine-1-carboxylate
Also Known As: 5-23-01-00264 (Beilstein Handbook Reference), 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester, Ethyl 4-(2-(ethoxycarbonylimino)ethyl)-1-piperazinecarboxylate, ethyl 4-[2-(ethoxycarbonylamino)ethyl]piperazine-1-carboxylate, ethyl 4-{2-[(ethoxycarbonyl)amino]ethyl}piperazine-1-carboxylate
| Molecular Formula | C12H23N3O4 |
|---|---|
| Molecular Weight | 273.17 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 273.16885 |
| Heavy Atoms | 19 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 55081-28-2 |
|---|---|
| SMILES | CCOC(=O)NCCN1CCN(CC1)C(=O)OCC |
| InChIKey | BXKNCMUUFRFHAX-UHFFFAOYSA-N |
Product Overview
1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester (CAS 55081-28-2), with molecular formula C12H23N3O4 and molecular weight 273.17 g/mol. IUPAC: ethyl 4-[2-(ethoxycarbonylamino)ethyl]piperazine-1-carboxylate.
Chemical Property Profile of 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester
Property Insights of 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester. Following Lipinski's Rule of Five, 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester has 1 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 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester?
The CAS number of 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester is 55081-28-2.
What is the molecular formula of 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester?
The molecular formula of 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester is C12H23N3O4.
What is the molecular weight of 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester?
The molecular weight of 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester is 273.17 g/mol.
Where can I buy 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester?
You can request a quote for 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinecarboxylic acid, 4-(2-(ethoxycarbonylimino)ethyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.