1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate
TL;DR: 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate (CAS 431995-82-3) is a chemical compound with molecular formula C13H19NO2S and molecular weight 253.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-piperidin-1-ylpropan-2-yl thiophene-2-carboxylate
Also Known As: TimTec1_006874, BAS 03335137, 1-(piperidin-1-yl)propan-2-yl thiophene-2-carboxylate, 1-methyl-2-piperidylethyl thiophene-2-carboxylate, 1-piperidin-1-ylpropan-2-yl thiophene-2-carboxylate
| Molecular Formula | C13H19NO2S |
|---|---|
| Molecular Weight | 253.11 g/mol |
| LogP | 2.7793 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.11365 |
| Heavy Atoms | 17 |
| Complexity | 344.31125 |
Chemical Identifiers
| CAS Number | 431995-82-3 |
|---|---|
| SMILES | CC(CN1CCCCC1)OC(=O)C2=CC=CS2 |
Product Overview
1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate (CAS 431995-82-3), with molecular formula C13H19NO2S and molecular weight 253.11 g/mol. IUPAC: 1-piperidin-1-ylpropan-2-yl thiophene-2-carboxylate.
Chemical Property Profile of 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate
Property Insights of 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate
The XLogP value of 2.7793 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate. With a topological polar surface area (TPSA) of 29.54 Ų, 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Piperidin-1-yl)propan-2-yl thiophene-2-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 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate?
The CAS number of 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate is 431995-82-3.
What is the molecular formula of 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate?
The molecular formula of 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate is C13H19NO2S.
What is the molecular weight of 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate?
The molecular weight of 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate is 253.11 g/mol.
Where can I buy 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate?
You can request a quote for 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-(Piperidin-1-yl)propan-2-yl thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.