1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone
TL;DR: 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone (CAS 332017-53-5) is a chemical compound with molecular formula C16H21NO2 and molecular weight 259.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-butyl-5-methoxy-2-methylindol-3-yl)ethanone
Also Known As: BAS 00796056, 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone, 1-(1-butyl-5-methoxy-2-methylindol-3-yl)ethanone, AB00092323-01, AE-848/33203040
| Molecular Formula | C16H21NO2 |
|---|---|
| Molecular Weight | 259.16 g/mol |
| LogP | 3.96102 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 259.15723 |
| Heavy Atoms | 19 |
| Complexity | 610.72675 |
Chemical Identifiers
| CAS Number | 332017-53-5 |
|---|---|
| SMILES | CCCCN1C(=C(C2=C1C=CC(=C2)OC)C(=O)C)C |
Product Overview
1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone (CAS 332017-53-5), with molecular formula C16H21NO2 and molecular weight 259.16 g/mol. IUPAC: 1-(1-butyl-5-methoxy-2-methylindol-3-yl)ethanone.
Chemical Property Profile of 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone
Property Insights of 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone
The XLogP value of 3.96102 indicates that 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.23 Ų, 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone has 0 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 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone?
The CAS number of 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone is 332017-53-5.
What is the molecular formula of 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone?
The molecular formula of 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone is C16H21NO2.
What is the molecular weight of 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone?
The molecular weight of 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone is 259.16 g/mol.
Where can I buy 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone?
You can request a quote for 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-butyl-5-methoxy-2-methyl-1H-indol-3-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.