(E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
TL;DR: (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide (CAS 1164540-72-0) is a chemical compound with molecular formula C29H29N3O5 and molecular weight 499.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-[2-(1H-indol-3-yl)ethylamino]-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide
Also Known As: (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide, N-[(1E)-3-{[2-(1H-indol-3-yl)ethyl]amino}-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide, N-[(E)-1-[2-(1H-Indol-3-yl)-ethylcarbamoyl]-2-(4-methoxy-phenyl)-vinyl]-3,4-dimethoxy-benzamide, N-[(E)-3-[2-(1H-indol-3-yl)ethylamino]-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide
| Molecular Formula | C29H29N3O5 |
|---|---|
| Molecular Weight | 499.21 g/mol |
| LogP | 4.3235 |
| Topological Polar Surface Area | 101.68 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 499.21072 |
| Heavy Atoms | 37 |
| Complexity | 1423.2687 |
Chemical Identifiers
| CAS Number | 1164540-72-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C=C(\C(=O)NCCC2=CNC3=CC=CC=C32)/NC(=O)C4=CC(=C(C=C4)OC)OC |
Product Overview
(E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide (CAS 1164540-72-0), with molecular formula C29H29N3O5 and molecular weight 499.21 g/mol. IUPAC: N-[(E)-3-[2-(1H-indol-3-yl)ethylamino]-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide.
Chemical Property Profile of (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
Property Insights of (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide
The XLogP value of 4.3235 indicates that (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide. Following Lipinski's Rule of Five, (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide has 3 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 (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide?
The CAS number of (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide is 1164540-72-0.
What is the molecular formula of (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide?
The molecular formula of (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide is C29H29N3O5.
What is the molecular weight of (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide?
The molecular weight of (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide is 499.21 g/mol.
Where can I buy (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide?
You can request a quote for (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-((2-(1H-indol-3-yl)ethyl)amino)-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl)-3,4-dimethoxybenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.