Methyl 4-(1H-indol-1-yl)butanoate
TL;DR: Methyl 4-(1H-indol-1-yl)butanoate (CAS 143217-46-3) is a chemical compound with molecular formula C13H15NO2 and molecular weight 217.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-indol-1-ylbutanoate
Also Known As: Methyl 4-(1H-indol-1-yl)butanoate, Methyl 4-indol-1-ylbutanoate, 1H-Indole-1-butanoic acid, methyl ester, 1H-Indole-1-butanoic acid methyl ester, J1.906.583I
| Molecular Formula | C13H15NO2 |
|---|---|
| Molecular Weight | 217.11 g/mol |
| LogP | 2.5945 |
| Topological Polar Surface Area | 31.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.11028 |
| Heavy Atoms | 16 |
| Complexity | 487.3932 |
Chemical Identifiers
| CAS Number | 143217-46-3 |
|---|---|
| SMILES | COC(=O)CCCN1C=CC2=CC=CC=C21 |
Product Overview
Methyl 4-(1H-indol-1-yl)butanoate (CAS 143217-46-3), with molecular formula C13H15NO2 and molecular weight 217.11 g/mol. IUPAC: methyl 4-indol-1-ylbutanoate.
Chemical Property Profile of Methyl 4-(1H-indol-1-yl)butanoate
Property Insights of Methyl 4-(1H-indol-1-yl)butanoate
The XLogP value of 2.5945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(1H-indol-1-yl)butanoate. With a topological polar surface area (TPSA) of 31.23 Ų, Methyl 4-(1H-indol-1-yl)butanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-(1H-indol-1-yl)butanoate 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 Methyl 4-(1H-indol-1-yl)butanoate?
The CAS number of Methyl 4-(1H-indol-1-yl)butanoate is 143217-46-3.
What is the molecular formula of Methyl 4-(1H-indol-1-yl)butanoate?
The molecular formula of Methyl 4-(1H-indol-1-yl)butanoate is C13H15NO2.
What is the molecular weight of Methyl 4-(1H-indol-1-yl)butanoate?
The molecular weight of Methyl 4-(1H-indol-1-yl)butanoate is 217.11 g/mol.
Where can I buy Methyl 4-(1H-indol-1-yl)butanoate?
You can request a quote for Methyl 4-(1H-indol-1-yl)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(1H-indol-1-yl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(1H-indol-1-yl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.