RefChem:272075
TL;DR: RefChem:272075 (CAS 42190-58-9) is a chemical compound with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4,4-dimethyl-3-oxopentyl)-4-(hydroxymethyl)-1,2-diphenylpyrazolidine-3,5-dione
Also Known As: 5-25-03-00287 (Beilstein Handbook Reference), 3,5-Pyrazolidinedione, 4-(4,4-dimethyl-3-oxopentyl)-1,2-diphenyl-4-(hydroxymethyl)-, 4-(4,4-Dimethyl-3-oxopentyl)-1,2-diphenyl-4-(hydroxymethyl)-3,5-pyrazolidinedione, 4-(4,4-dimethyl-3-oxopentyl)-4-(hydroxymethyl)-1,2-diphenylpyrazolidine-3,5-dione, BRN 0717412
| Molecular Formula | C23H26N2O4 |
|---|---|
| Molecular Weight | 394.19 g/mol |
| LogP | 3.3555 |
| Topological Polar Surface Area | 77.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 394.18927 |
| Heavy Atoms | 29 |
| Complexity | 845.98 |
Chemical Identifiers
| CAS Number | 42190-58-9 |
|---|---|
| SMILES | CC(C)(C)C(=O)CCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CO |
Product Overview
RefChem:272075 (CAS 42190-58-9), with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol. IUPAC: 4-(4,4-dimethyl-3-oxopentyl)-4-(hydroxymethyl)-1,2-diphenylpyrazolidine-3,5-dione.
Chemical Property Profile of RefChem:272075
Property Insights of RefChem:272075
The XLogP value of 3.3555 indicates that RefChem:272075 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.92 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:272075. Following Lipinski's Rule of Five, RefChem:272075 has 1 hydrogen bond donor(s) and 4 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 RefChem:272075?
The CAS number of RefChem:272075 is 42190-58-9.
What is the molecular formula of RefChem:272075?
The molecular formula of RefChem:272075 is C23H26N2O4.
What is the molecular weight of RefChem:272075?
The molecular weight of RefChem:272075 is 394.19 g/mol.
Where can I buy RefChem:272075?
You can request a quote for RefChem:272075 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:272075?
Yes, KEHONG BIO provides custom synthesis services for RefChem:272075 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.