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Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate
TL;DR: Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate (CAS 694463-96-2) is a chemical compound with molecular formula C19H20IN3O5 and molecular weight 497.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(furan-2-carbonylamino)-5-iodobenzoyl]piperazine-1-carboxylate
Also Known As: AP-064/41806567, ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate, ethyl 4-[2-(furan-2-carbonylamino)-5-iodobenzoyl]piperazine-1-carboxylate, ethyl 4-(2-(furan-2-carboxamido)-5-iodobenzoyl)piperazine-1-carboxylate, Ethyl 4-[2-(furan-2-carbonylamino)-5-iodo-benzoyl]piperazine-1-carboxylate
| Molecular Formula | C19H20IN3O5 |
|---|---|
| Molecular Weight | 497.04 g/mol |
| LogP | 3.0508 |
| Topological Polar Surface Area | 92.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 497.04477 |
| Heavy Atoms | 28 |
| Complexity | 860.459 |
Chemical Identifiers
| CAS Number | 694463-96-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)C2=C(C=CC(=C2)I)NC(=O)C3=CC=CO3 |
Product Overview
Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate (CAS 694463-96-2), with molecular formula C19H20IN3O5 and molecular weight 497.04 g/mol. IUPAC: ethyl 4-[2-(furan-2-carbonylamino)-5-iodobenzoyl]piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate
Property Insights of Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate
The XLogP value of 3.0508 indicates that Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.09 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate. Following Lipinski's Rule of Five, Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate 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 Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate?
The CAS number of Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate is 694463-96-2.
What is the molecular formula of Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate?
The molecular formula of Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate is C19H20IN3O5.
What is the molecular weight of Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate?
The molecular weight of Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate is 497.04 g/mol.
Where can I buy Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate?
You can request a quote for Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[2-(2-furoylamino)-5-iodobenzoyl]-1-piperazinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.