methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate
TL;DR: methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate (CAS 877779-80-1) is a chemical compound with molecular formula C26H31N3O4 and molecular weight 449.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[2-(4-benzylpiperidin-1-yl)propanoylamino]-4-methoxy-1H-indole-2-carboxylate
Also Known As: methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate, Methyl 3-[2-(4-benzyl-1-piperidyl)propanoylamino]-4-methoxy-1H-indole-2-carboxylate, methyl 3-[2-(4-benzylpiperidin-1-yl)propanoylamino]-4-methoxy-1H-indole-2-carboxylate, methyl 3-{[2-(4-benzylpiperidin-1-yl)propanoyl]amino}-4-methoxy-1H-indole-2-carboxylate
| Molecular Formula | C26H31N3O4 |
|---|---|
| Molecular Weight | 449.23 g/mol |
| LogP | 4.2448 |
| Topological Polar Surface Area | 83.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.23145 |
| Heavy Atoms | 33 |
| Complexity | 1117.2723 |
Chemical Identifiers
| CAS Number | 877779-80-1 |
|---|---|
| SMILES | CC(C(=O)NC1=C(NC2=C1C(=CC=C2)OC)C(=O)OC)N3CCC(CC3)CC4=CC=CC=C4 |
Product Overview
methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate (CAS 877779-80-1), with molecular formula C26H31N3O4 and molecular weight 449.23 g/mol. IUPAC: methyl 3-[2-(4-benzylpiperidin-1-yl)propanoylamino]-4-methoxy-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate
Property Insights of methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate
The XLogP value of 4.2448 indicates that methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.66 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate has 2 hydrogen bond donor(s) and 5 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-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate?
The CAS number of methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate is 877779-80-1.
What is the molecular formula of methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate?
The molecular formula of methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate is C26H31N3O4.
What is the molecular weight of methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate?
The molecular weight of methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate is 449.23 g/mol.
Where can I buy methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate?
You can request a quote for methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-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 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(2-(4-benzylpiperidin-1-yl)propanamido)-4-methoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.