5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one
TL;DR: 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one (CAS 614747-88-5) is a chemical compound with molecular formula C26H29ClN2O4 and molecular weight 468.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-[2-(diethylamino)ethyl]-5-(3-prop-2-enoxyphenyl)pyrrolidine-2,3-dione
Also Known As: 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one, (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-(2-diethylaminoethyl)-5-(3-prop-2-enoxyphenyl)pyrrolidine-2,3-dione, 1-[2-(diethylamino)ethyl]-4-[(4-chlorophenyl)carbonyl]-3-hydroxy-5-(3-prop-2-e nyloxyphenyl)-3-pyrrolin-2-one
| Molecular Formula | C26H29ClN2O4 |
|---|---|
| Molecular Weight | 468.18 g/mol |
| LogP | 4.6683 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 468.18158 |
| Heavy Atoms | 33 |
| Complexity | 1044.5123 |
Chemical Identifiers
| CAS Number | 614747-88-5 |
|---|---|
| SMILES | CCN(CC)CCN1C(/C(=C(/C2=CC=C(C=C2)Cl)\O)/C(=O)C1=O)C3=CC(=CC=C3)OCC=C |
Product Overview
5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one (CAS 614747-88-5), with molecular formula C26H29ClN2O4 and molecular weight 468.18 g/mol. IUPAC: (4E)-4-[(4-chlorophenyl)-hydroxymethylidene]-1-[2-(diethylamino)ethyl]-5-(3-prop-2-enoxyphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one
Property Insights of 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one
The XLogP value of 4.6683 indicates that 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one 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 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
The CAS number of 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one is 614747-88-5.
What is the molecular formula of 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
The molecular formula of 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one is C26H29ClN2O4.
What is the molecular weight of 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
The molecular weight of 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one is 468.18 g/mol.
Where can I buy 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
You can request a quote for 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-(allyloxy)phenyl)-4-(4-chlorobenzoyl)-1-(2-(diethylamino)ethyl)-3-hydroxy-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.