![2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide structure](/static/products/488/488804-35-9.png)
2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide
TL;DR: 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide (CAS 488804-35-9) is a chemical compound with molecular formula C29H28ClN3O4 and molecular weight 517.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(Z)-3-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(1-methylindol-3-yl)-3-oxoprop-1-en-2-yl]benzamide
Also Known As: 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide, (Z)-2-chloro-N-(3-((3,4-dimethoxyphenethyl)amino)-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl)benzamide, 2-chloro-N-[(Z)-3-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(1-methylindol-3-yl)-3-oxoprop-1-en-2-yl]benzamide, 2-chloro-N-[1-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-2-(1-methylindol-3-yl)ethenyl]benzamide
| Molecular Formula | C29H28ClN3O4 |
|---|---|
| Molecular Weight | 517.18 g/mol |
| LogP | 4.9787 |
| Topological Polar Surface Area | 81.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 517.1768 |
| Heavy Atoms | 37 |
| Complexity | 1475.2957 |
Chemical Identifiers
| CAS Number | 488804-35-9 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)/C=C(/C(=O)NCCC3=CC(=C(C=C3)OC)OC)\NC(=O)C4=CC=CC=C4Cl |
Product Overview
2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide (CAS 488804-35-9), with molecular formula C29H28ClN3O4 and molecular weight 517.18 g/mol. IUPAC: 2-chloro-N-[(Z)-3-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(1-methylindol-3-yl)-3-oxoprop-1-en-2-yl]benzamide.
Chemical Property Profile of 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide
Property Insights of 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide
The XLogP value of 4.9787 indicates that 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide. Following Lipinski's Rule of Five, 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide has 2 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 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide?
The CAS number of 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide is 488804-35-9.
What is the molecular formula of 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide?
The molecular formula of 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide is C29H28ClN3O4.
What is the molecular weight of 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide?
The molecular weight of 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide is 517.18 g/mol.
Where can I buy 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide?
You can request a quote for 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[(1Z)-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-(1-methyl-1H-indol-3-yl)-3-oxoprop-1-en-2-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.