ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate
TL;DR: ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate (CAS 904501-18-4) is a chemical compound with molecular formula C16H22N4O4S and molecular weight 366.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate
Also Known As: ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate, ethyl 4-((3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl)piperazine-1-carboxylate
| Molecular Formula | C16H22N4O4S |
|---|---|
| Molecular Weight | 366.14 g/mol |
| LogP | 1.6417 |
| Topological Polar Surface Area | 104.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 366.13617 |
| Heavy Atoms | 25 |
| Complexity | 694.552 |
Chemical Identifiers
| CAS Number | 904501-18-4 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)N |
Product Overview
ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate (CAS 904501-18-4), with molecular formula C16H22N4O4S and molecular weight 366.14 g/mol. IUPAC: ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate
Property Insights of ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate
The XLogP value of 1.6417 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate. The TPSA of 104.97 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate. Following Lipinski's Rule of Five, ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate has 2 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-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate?
The CAS number of ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate is 904501-18-4.
What is the molecular formula of ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate?
The molecular formula of ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate is C16H22N4O4S.
What is the molecular weight of ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate?
The molecular weight of ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate is 366.14 g/mol.
Where can I buy ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate?
You can request a quote for ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)carbamoyl]piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.