Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate
TL;DR: Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate (CAS 1007932-18-4) is a chemical compound with molecular formula C15H18ClN3O4 and molecular weight 339.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[1-[(4-chlorophenyl)carbamoyl]-3-oxopiperazin-2-yl]acetate
Also Known As: ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate, ethyl 2-[1-[(4-chlorophenyl)carbamoyl]-3-oxopiperazin-2-yl]acetate, ethyl 2-{1-[(4-chlorophenyl)carbamoyl]-3-oxopiperazin-2-yl}acetate, 2-Piperazineacetic acid, 1-[[(4-chlorophenyl)amino]carbonyl]-3-oxo-, ethyl ester, ethyl2-{1-[(4-chlorophenyl)carbamoyl]-3-oxopiperazin-2-yl}acetate
| Molecular Formula | C15H18ClN3O4 |
|---|---|
| Molecular Weight | 339.10 g/mol |
| LogP | 1.6255 |
| Topological Polar Surface Area | 87.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.09857 |
| Heavy Atoms | 23 |
| Complexity | 590.8897 |
Chemical Identifiers
| CAS Number | 1007932-18-4 |
|---|---|
| SMILES | CCOC(=O)CC1C(=O)NCCN1C(=O)NC2=CC=C(C=C2)Cl |
Product Overview
Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate (CAS 1007932-18-4), with molecular formula C15H18ClN3O4 and molecular weight 339.10 g/mol. IUPAC: ethyl 2-[1-[(4-chlorophenyl)carbamoyl]-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate
Property Insights of Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate
The XLogP value of 1.6255 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate. The TPSA of 87.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate. Following Lipinski's Rule of Five, Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate 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-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate?
The CAS number of Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate is 1007932-18-4.
What is the molecular formula of Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate?
The molecular formula of Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate is C15H18ClN3O4.
What is the molecular weight of Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate?
The molecular weight of Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate is 339.10 g/mol.
Where can I buy Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate?
You can request a quote for Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}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-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{1-[(4-chloroanilino)carbonyl]-3-oxo-2-piperazinyl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.