Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate
TL;DR: Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate (CAS 20449-14-3) is a chemical compound with molecular formula C14H25NO4S and molecular weight 303.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate
Also Known As: ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate, ethyl 2-[(Z)-1-piperidin-1-ylbut-1-en-2-yl]sulfonylpropanoat
| Molecular Formula | C14H25NO4S |
|---|---|
| Molecular Weight | 303.15 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 303.15042 |
| Heavy Atoms | 20 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 20449-14-3 |
|---|---|
| SMILES | CCC(=CN1CCCCC1)S(=O)(=O)C(C)C(=O)OCC |
| InChIKey | OLHFLOJRNDCFFC-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate (CAS 20449-14-3), with molecular formula C14H25NO4S and molecular weight 303.15 g/mol. IUPAC: ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate.
Chemical Property Profile of Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate
Property Insights of Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate. Following Lipinski's Rule of Five, Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate has 0 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 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate?
The CAS number of Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate is 20449-14-3.
What is the molecular formula of Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate?
The molecular formula of Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate is C14H25NO4S.
What is the molecular weight of Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate?
The molecular weight of Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate is 303.15 g/mol.
Where can I buy Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate?
You can request a quote for Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate 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-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(1-piperidin-1-ylbut-1-en-2-ylsulfonyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.