3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide
TL;DR: 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide (CAS 6884-90-8) is a chemical compound with molecular formula C28H25Cl2N3O4 and molecular weight 537.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(2,6-diethylphenyl)benzamide
Also Known As: 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide, 3-[[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(2,6-diethylphenyl)benzamide
| Molecular Formula | C28H25Cl2N3O4 |
|---|---|
| Molecular Weight | 537.12 g/mol |
| LogP | 6.1614 |
| Topological Polar Surface Area | 87.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 537.1222 |
| Heavy Atoms | 37 |
| Complexity | 1412.4247 |
Chemical Identifiers
| CAS Number | 6884-90-8 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC(=CC=C2)NC3=C(C(=O)N(C3=O)C4=C(C=CC(=C4)Cl)OC)Cl |
Product Overview
3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide (CAS 6884-90-8), with molecular formula C28H25Cl2N3O4 and molecular weight 537.12 g/mol. IUPAC: 3-[[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(2,6-diethylphenyl)benzamide.
Chemical Property Profile of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide
Property Insights of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide
The XLogP value of 6.1614 indicates that 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide. Following Lipinski's Rule of Five, 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide?
The CAS number of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide is 6884-90-8.
What is the molecular formula of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide?
The molecular formula of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide is C28H25Cl2N3O4.
What is the molecular weight of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide?
The molecular weight of 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide is 537.12 g/mol.
Where can I buy 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide?
You can request a quote for 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-{[4-chloro-1-(5-chloro-2-methoxyphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(2,6-diethylphenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.