Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate
TL;DR: Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate (CAS 728906-37-4) is a chemical compound with molecular formula C31H34N2O4 and molecular weight 498.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethoxy]-1-(2-phenylethyl)indole-3-carboxylate
Also Known As: Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate, ethyl 2-methyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethoxy]-1-phenethylindole-3-carboxylate, ethyl 2-methyl-5-(2-oxo-2-{[4-(propan-2-yl)phenyl]amino}ethoxy)-1-(2-phenylethyl)-1H-indole-3-carboxylate, ethyl 5-(2-((4-isopropylphenyl)amino)-2-oxoethoxy)-2-methyl-1-phenethyl-1H-indole-3-carboxylate
| Molecular Formula | C31H34N2O4 |
|---|---|
| Molecular Weight | 498.25 g/mol |
| LogP | 6.51002 |
| Topological Polar Surface Area | 69.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 498.25186 |
| Heavy Atoms | 37 |
| Complexity | 1372.1127 |
Chemical Identifiers
| CAS Number | 728906-37-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OCC(=O)NC3=CC=C(C=C3)C(C)C)CCC4=CC=CC=C4)C |
Product Overview
Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate (CAS 728906-37-4), with molecular formula C31H34N2O4 and molecular weight 498.25 g/mol. IUPAC: ethyl 2-methyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethoxy]-1-(2-phenylethyl)indole-3-carboxylate.
Chemical Property Profile of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate
Property Insights of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate
The XLogP value of 6.51002 indicates that Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate?
The CAS number of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate is 728906-37-4.
What is the molecular formula of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate?
The molecular formula of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate is C31H34N2O4.
What is the molecular weight of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate?
The molecular weight of Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate is 498.25 g/mol.
Where can I buy Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate?
You can request a quote for Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-1-phenethyl-5-[(4-propan-2-ylphenyl)carbamoylmethoxy]indole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.