4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one
TL;DR: 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one (CAS 488121-11-5) is a chemical compound with molecular formula C38H38N2O6 and molecular weight 618.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione
Also Known As: 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one, 4-[4-(BENZYLOXY)-2-METHYLBENZOYL]-3-HYDROXY-1-[3-(4-MORPHOLINYL)PROPYL]-5-(3-PHENOXYPHENYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, (4E)-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione, 4-(4-(BENZYLOXY)-2-METHYLBENZOYL)-3-HYDROXY-1-(3-(4-MORPHOLINYL)PROPYL)-5-(3-PHENOXYPHENYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 4-{[4-(benzyloxy)-2-methylphenyl]carbonyl}-3-hydroxy-1-[3-(morpholin-4-yl)propyl]-5-(3-phenoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C38H38N2O6 |
|---|---|
| Molecular Weight | 618.27 g/mol |
| LogP | 6.51032 |
| Topological Polar Surface Area | 88.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 618.273 |
| Heavy Atoms | 46 |
| Complexity | 1699.054 |
Chemical Identifiers
| CAS Number | 488121-11-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC2=CC=CC=C2)/C(=C\3/C(N(C(=O)C3=O)CCCN4CCOCC4)C5=CC(=CC=C5)OC6=CC=CC=C6)/O |
Product Overview
4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one (CAS 488121-11-5), with molecular formula C38H38N2O6 and molecular weight 618.27 g/mol. IUPAC: (4E)-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-1-(3-morpholin-4-ylpropyl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione.
Chemical Property Profile of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one
Property Insights of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one
The XLogP value of 6.51032 indicates that 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one. Following Lipinski's Rule of Five, 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one?
The CAS number of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one is 488121-11-5.
What is the molecular formula of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one?
The molecular formula of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one is C38H38N2O6.
What is the molecular weight of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one?
The molecular weight of 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one is 618.27 g/mol.
Where can I buy 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one?
You can request a quote for 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-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 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-(Benzyloxy)-2-methylbenzoyl)-3-hydroxy-1-(3-morpholinopropyl)-5-(3-phenoxyphenyl)-1H-pyrrol-2(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.