![methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate structure](/static/products/866/866149-54-4.png)
methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate
TL;DR: methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate (CAS 866149-54-4) is a chemical compound with molecular formula C25H24N2O4 and molecular weight 416.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-hydroxy-4-[(5-methoxyindol-3-ylidene)methyl]-2-methyl-1-(2-phenylethyl)pyrrole-3-carboxylate
Also Known As: methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate
| Molecular Formula | C25H24N2O4 |
|---|---|
| Molecular Weight | 416.17 g/mol |
| LogP | 4.79652 |
| Topological Polar Surface Area | 73.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.1736 |
| Heavy Atoms | 31 |
| Complexity | 1189.9762 |
Chemical Identifiers
| CAS Number | 866149-54-4 |
|---|---|
| SMILES | CC1=C(C(=C(N1CCC2=CC=CC=C2)O)C=C3C=NC4=C3C=C(C=C4)OC)C(=O)OC |
Product Overview
methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate (CAS 866149-54-4), with molecular formula C25H24N2O4 and molecular weight 416.17 g/mol. IUPAC: methyl 5-hydroxy-4-[(5-methoxyindol-3-ylidene)methyl]-2-methyl-1-(2-phenylethyl)pyrrole-3-carboxylate.
Chemical Property Profile of methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate
Property Insights of methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate
The XLogP value of 4.79652 indicates that methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.05 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate. Following Lipinski's Rule of Five, methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate has 1 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-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate?
The CAS number of methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate is 866149-54-4.
What is the molecular formula of methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate?
The molecular formula of methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate is C25H24N2O4.
What is the molecular weight of methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate?
The molecular weight of methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate is 416.17 g/mol.
Where can I buy methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate?
You can request a quote for methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-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-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[(Z)-(5-methoxy-1H-indol-3-yl)methylidene]-5-methyl-2-oxo-1-phenethyl-1,2-dihydro-3H-pyrrole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.