![methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate structure](/static/products/6674/667435-96-3.webp)
methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate
TL;DR: methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate (CAS 667435-96-3) is a chemical compound with molecular formula C18H15NO3 and molecular weight 293.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(3-formylindol-1-yl)methyl]benzoate
Also Known As: methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate, methyl 3-[(3-formylindol-1-yl)methyl]benzoate, Methyl 3-((3-formyl-1H-indol-1-yl)methyl)benzoate, methyl 3-[(3-formylindolyl)methyl]benzoate, Methyl 3-(3-formyl-1H-indol-1-yl)methylbenzoate
| Molecular Formula | C18H15NO3 |
|---|---|
| Molecular Weight | 293.11 g/mol |
| LogP | 3.2887 |
| Topological Polar Surface Area | 48.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.1052 |
| Heavy Atoms | 22 |
| Complexity | 848.4145 |
Chemical Identifiers
| CAS Number | 667435-96-3 |
|---|---|
| SMILES | COC(=O)C1=CC=CC(=C1)CN2C=C(C3=CC=CC=C32)C=O |
Product Overview
methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate (CAS 667435-96-3), with molecular formula C18H15NO3 and molecular weight 293.11 g/mol. IUPAC: methyl 3-[(3-formylindol-1-yl)methyl]benzoate.
Chemical Property Profile of methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate
Property Insights of methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate
The XLogP value of 3.2887 indicates that methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.3 Ų, methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate has 0 hydrogen bond donor(s) and 3 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 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate?
The CAS number of methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate is 667435-96-3.
What is the molecular formula of methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate?
The molecular formula of methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate is C18H15NO3.
What is the molecular weight of methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate?
The molecular weight of methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate is 293.11 g/mol.
Where can I buy methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate?
You can request a quote for methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[(3-formyl-1H-indol-1-yl)methyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.