![Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate structure](/static/products/6904/6904-88-7.webp)
Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate
TL;DR: Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate (CAS 6904-88-7) is a chemical compound with molecular formula C26H21ClN2O5 and molecular weight 476.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)pyrrol-1-yl]benzoate
Also Known As: Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate, propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)pyrrol-1-yl]benzoate, Propyl 4-[3-chloro-2,5-dioxo-4-[(4-phenoxyphenyl)amino]pyrrol-1-yl]benzoate
| Molecular Formula | C26H21ClN2O5 |
|---|---|
| Molecular Weight | 476.11 g/mol |
| LogP | 5.4814 |
| Topological Polar Surface Area | 84.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 476.1139 |
| Heavy Atoms | 34 |
| Complexity | 1238.4473 |
Chemical Identifiers
| CAS Number | 6904-88-7 |
|---|---|
| SMILES | CCCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)OC4=CC=CC=C4 |
Product Overview
Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate (CAS 6904-88-7), with molecular formula C26H21ClN2O5 and molecular weight 476.11 g/mol. IUPAC: propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)pyrrol-1-yl]benzoate.
Chemical Property Profile of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate
Property Insights of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate
The XLogP value of 5.4814 indicates that Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate. Following Lipinski's Rule of Five, Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate?
The CAS number of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate is 6904-88-7.
What is the molecular formula of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate?
The molecular formula of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate is C26H21ClN2O5.
What is the molecular weight of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate?
The molecular weight of Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate is 476.11 g/mol.
Where can I buy Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate?
You can request a quote for Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 4-[3-chloro-2,5-dioxo-4-(4-phenoxyanilino)-2,5-dihydro-1H-pyrrol-1-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.