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2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone
TL;DR: 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone (CAS 536701-68-5) is a chemical compound with molecular formula C16H20N2OS and molecular weight 288.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone
Also Known As: 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone, 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-(piperidin-1-yl)ethan-1-one, 2-((2-methyl-1H-indol-3-yl)thio)-1-(piperidin-1-yl)ethanone
| Molecular Formula | C16H20N2OS |
|---|---|
| Molecular Weight | 288.13 g/mol |
| LogP | 3.58092 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.12964 |
| Heavy Atoms | 20 |
| Complexity | 613.9644 |
Chemical Identifiers
| CAS Number | 536701-68-5 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2N1)SCC(=O)N3CCCCC3 |
Product Overview
2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone (CAS 536701-68-5), with molecular formula C16H20N2OS and molecular weight 288.13 g/mol. IUPAC: 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone.
Chemical Property Profile of 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone
Property Insights of 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone
The XLogP value of 3.58092 indicates that 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.1 Ų, 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone has 1 hydrogen bond donor(s) and 2 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 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone?
The CAS number of 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone is 536701-68-5.
What is the molecular formula of 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone?
The molecular formula of 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone is C16H20N2OS.
What is the molecular weight of 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone?
The molecular weight of 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone is 288.13 g/mol.
Where can I buy 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone?
You can request a quote for 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-methyl-1H-indol-3-yl)sulfanyl]-1-piperidin-1-ylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.