Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate
TL;DR: Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate (CAS 325851-66-9) is a chemical compound with molecular formula C15H17NO4S and molecular weight 307.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-ynyl 4-piperidin-1-ylsulfonylbenzoate
Also Known As: BAS 00634361, prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate, prop-2-ynyl 4-(piperidylsulfonyl)benzoate, 2-propynyl 4-(1-piperidinylsulfonyl)benzoate, prop-2-ynyl 4-piperidin-1-ylsulfonylbenzoate
| Molecular Formula | C15H17NO4S |
|---|---|
| Molecular Weight | 307.09 g/mol |
| LogP | 1.6512 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.08783 |
| Heavy Atoms | 21 |
| Complexity | 637.24634 |
Chemical Identifiers
| CAS Number | 325851-66-9 |
|---|---|
| SMILES | C#CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2 |
Product Overview
Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate (CAS 325851-66-9), with molecular formula C15H17NO4S and molecular weight 307.09 g/mol. IUPAC: prop-2-ynyl 4-piperidin-1-ylsulfonylbenzoate.
Chemical Property Profile of Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate
Property Insights of Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate
The XLogP value of 1.6512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate. Following Lipinski's Rule of Five, Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate 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 Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate?
The CAS number of Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate is 325851-66-9.
What is the molecular formula of Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate?
The molecular formula of Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate is C15H17NO4S.
What is the molecular weight of Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate?
The molecular weight of Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate is 307.09 g/mol.
Where can I buy Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate?
You can request a quote for Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Prop-2-yn-1-yl 4-(piperidin-1-ylsulfonyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.