![(4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione structure](/static/products/955/955898-39-2.png)
(4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione
TL;DR: (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione (CAS 955898-39-2) is a chemical compound with molecular formula C29H34N4O3 and molecular weight 486.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-tert-butylphenyl)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione
Also Known As: (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione, 1-[2-(dimethylamino)ethyl]-5-[4-(tert-butyl)phenyl]-3-hydroxy-4-[(5-methyl-1-p henylpyrazol-4-yl)carbonyl]-3-pyrrolin-2-one, 5-(4-(tert-butyl)phenyl)-1-(2-(dimethylamino)ethyl)-3-hydroxy-4-(5-methyl-1-phenyl-1H-pyrazole-4-carbonyl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C29H34N4O3 |
|---|---|
| Molecular Weight | 486.26 g/mol |
| LogP | 4.46152 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 486.2631 |
| Heavy Atoms | 36 |
| Complexity | 1298.5372 |
Chemical Identifiers
| CAS Number | 955898-39-2 |
|---|---|
| SMILES | CC1=C(C=NN1C2=CC=CC=C2)/C(=C\3/C(N(C(=O)C3=O)CCN(C)C)C4=CC=C(C=C4)C(C)(C)C)/O |
Product Overview
(4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione (CAS 955898-39-2), with molecular formula C29H34N4O3 and molecular weight 486.26 g/mol. IUPAC: (4E)-5-(4-tert-butylphenyl)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione
Property Insights of (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione
The XLogP value of 4.46152 indicates that (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione. Following Lipinski's Rule of Five, (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione 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 (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione?
The CAS number of (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione is 955898-39-2.
What is the molecular formula of (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione?
The molecular formula of (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione is C29H34N4O3.
What is the molecular weight of (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione?
The molecular weight of (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione is 486.26 g/mol.
Where can I buy (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione?
You can request a quote for (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (4E)-5-(4-tert-butylphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]pyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.