1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester
TL;DR: 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester (CAS 55590-99-3) is a chemical compound with molecular formula C16H23NO2Si and molecular weight 289.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(1-trimethylsilylindol-3-yl)butanoate
Also Known As: 1-1h-indole-3-butanoicacidmethylester, 1- -1H-indole-3-butanoicacidmethylester, Methyl indole-3-butyrate, TMS derivative, methyl 4-(1-trimethylsilylindol-3-yl)butanoate, Methyl 4-[1-(trimethylsilyl)-1H-indol-3-yl]butanoate
| Molecular Formula | C16H23NO2Si |
|---|---|
| Molecular Weight | 289.15 g/mol |
| LogP | 3.82 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 289.1498 |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 55590-99-3 |
|---|---|
| SMILES | COC(=O)CCCC1=CN(C2=CC=CC=C21)[Si](C)(C)C |
| InChIKey | YBPHHYVMXBAUBN-UHFFFAOYSA-N |
Product Overview
1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester (CAS 55590-99-3), with molecular formula C16H23NO2Si and molecular weight 289.15 g/mol. IUPAC: methyl 4-(1-trimethylsilylindol-3-yl)butanoate.
Chemical Property Profile of 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester
Property Insights of 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester
The XLogP value of 3.82 indicates that 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.2 Ų, 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester 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 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester?
The CAS number of 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester is 55590-99-3.
What is the molecular formula of 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester?
The molecular formula of 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester is C16H23NO2Si.
What is the molecular weight of 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester?
The molecular weight of 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester is 289.15 g/mol.
Where can I buy 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester?
You can request a quote for 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-3-butanoic acid, 1-(trimethylsilyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.