![3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one structure](/static/products/333/333776-89-9.png)
3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
TL;DR: 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one (CAS 333776-89-9) is a chemical compound with molecular formula C21H18N2O6 and molecular weight 394.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-1-(2-hydroxyethyl)-2-(3-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one
Also Known As: 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one, 4-cinnamoyl-3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one, 3-Hydroxy-1-(2-hydroxy-ethyl)-5-(3-nitro-phenyl)-4-[(E)-(3-phenyl-acryloyl)]-1,5-dihydro-pyrrol-2-one, 4-hydroxy-1-(2-hydroxyethyl)-2-(3-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one
| Molecular Formula | C21H18N2O6 |
|---|---|
| Molecular Weight | 394.12 g/mol |
| LogP | 2.565 |
| Topological Polar Surface Area | 120.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.1165 |
| Heavy Atoms | 29 |
| Complexity | 1012.8412 |
Chemical Identifiers
| CAS Number | 333776-89-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)C2=C(C(=O)N(C2C3=CC(=CC=C3)[N+](=O)[O-])CCO)O |
Product Overview
3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one (CAS 333776-89-9), with molecular formula C21H18N2O6 and molecular weight 394.12 g/mol. IUPAC: 4-hydroxy-1-(2-hydroxyethyl)-2-(3-nitrophenyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one.
Chemical Property Profile of 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Property Insights of 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
The XLogP value of 2.565 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one. The TPSA of 120.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one. Following Lipinski's Rule of Five, 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one has 2 hydrogen bond donor(s) and 6 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 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one?
The CAS number of 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one is 333776-89-9.
What is the molecular formula of 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one?
The molecular formula of 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one is C21H18N2O6.
What is the molecular weight of 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one?
The molecular weight of 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one is 394.12 g/mol.
Where can I buy 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one?
You can request a quote for 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-hydroxy-1-(2-hydroxyethyl)-5-(3-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.