ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate
TL;DR: ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate (CAS 83177-91-7) is a chemical compound with molecular formula C19H30N2O3 and molecular weight 334.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate
Also Known As: ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydrop, ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate
| Molecular Formula | C19H30N2O3 |
|---|---|
| Molecular Weight | 334.23 g/mol |
| LogP | 3.514 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 334.22565 |
| Heavy Atoms | 24 |
| Complexity | 504.7413 |
Chemical Identifiers
| CAS Number | 83177-91-7 |
|---|---|
| SMILES | CCCCCC(=O)/C=C/C1=C(CN(C1)C(=O)OCC)N2CCCC2 |
Product Overview
ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate (CAS 83177-91-7), with molecular formula C19H30N2O3 and molecular weight 334.23 g/mol. IUPAC: ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate.
Chemical Property Profile of ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate
Property Insights of ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate
The XLogP value of 3.514 indicates that ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate has 0 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 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate?
The CAS number of ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate is 83177-91-7.
What is the molecular formula of ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate?
The molecular formula of ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate is C19H30N2O3.
What is the molecular weight of ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate?
The molecular weight of ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate is 334.23 g/mol.
Where can I buy ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate?
You can request a quote for ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-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 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-[(E)-3-oxooct-1-enyl]-4-pyrrolidin-1-yl-2,5-dihydropyrrole-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.