methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate
TL;DR: methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate (CAS 167479-10-9) is a chemical compound with molecular formula C18H17NO3 and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methyl-4-phenylmethoxyindole-2-carboxylate
Also Known As: methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate, methyl 4-(benzyloxy)-1-methylindole-2-carboxylate, methyl 1-methyl-4-phenylmethoxyindole-2-carboxylate, methyl 4-benzyloxy-1-methyl-2-indolecarboxylate, methyl 4-benzyloxy-1-methyl-indole-2-carboxylate
| Molecular Formula | C18H17NO3 |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 3.5439 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.12085 |
| Heavy Atoms | 22 |
| Complexity | 805.81525 |
Chemical Identifiers
| CAS Number | 167479-10-9 |
|---|---|
| SMILES | CN1C2=C(C=C1C(=O)OC)C(=CC=C2)OCC3=CC=CC=C3 |
Product Overview
methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate (CAS 167479-10-9), with molecular formula C18H17NO3 and molecular weight 295.12 g/mol. IUPAC: methyl 1-methyl-4-phenylmethoxyindole-2-carboxylate.
Chemical Property Profile of methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate
Property Insights of methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate
The XLogP value of 3.5439 indicates that methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate 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 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate?
The CAS number of methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate is 167479-10-9.
What is the molecular formula of methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate?
The molecular formula of methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate is C18H17NO3.
What is the molecular weight of methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate?
The molecular weight of methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate is 295.12 g/mol.
Where can I buy methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate?
You can request a quote for methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(benzyloxy)-1-methyl-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.