5-25-03-00345 (Beilstein Handbook Reference)
TL;DR: 5-25-03-00345 (Beilstein Handbook Reference) (CAS 42190-65-8) is a chemical compound with molecular formula C41H52N2O5 and molecular weight 652.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,5-dioxo-4-(3-oxo-3-phenylpropyl)-1,2-diphenylpyrazolidin-4-yl]methyl hexadecanoate
Also Known As: 5-25-03-00345 (Beilstein Handbook Reference), Hexadecanoic acid, (3,5-dioxo-4-(3-oxo-3-phenylpropyl)-1,2-diphenyl-4-pyrazolidinyl)methyl ester, [3,5-dioxo-4-(3-oxo-3-phenylpropyl)-1,2-diphenylpyrazolidin-4-yl]methyl hexadecanoate, BRN 0737096
| Molecular Formula | C41H52N2O5 |
|---|---|
| Molecular Weight | 652.39 g/mol |
| LogP | 9.6554 |
| Topological Polar Surface Area | 83.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 22 |
| Exact Mass | 652.38763 |
| Heavy Atoms | 48 |
| Complexity | 1369.4758 |
Chemical Identifiers
| CAS Number | 42190-65-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC1(C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)CCC(=O)C4=CC=CC=C4 |
Product Overview
5-25-03-00345 (Beilstein Handbook Reference) (CAS 42190-65-8), with molecular formula C41H52N2O5 and molecular weight 652.39 g/mol. IUPAC: [3,5-dioxo-4-(3-oxo-3-phenylpropyl)-1,2-diphenylpyrazolidin-4-yl]methyl hexadecanoate.
Chemical Property Profile of 5-25-03-00345 (Beilstein Handbook Reference)
Property Insights of 5-25-03-00345 (Beilstein Handbook Reference)
The XLogP value of 9.6554 indicates that 5-25-03-00345 (Beilstein Handbook Reference) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-25-03-00345 (Beilstein Handbook Reference). Following Lipinski's Rule of Five, 5-25-03-00345 (Beilstein Handbook Reference) has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-25-03-00345 (Beilstein Handbook Reference)?
The CAS number of 5-25-03-00345 (Beilstein Handbook Reference) is 42190-65-8.
What is the molecular formula of 5-25-03-00345 (Beilstein Handbook Reference)?
The molecular formula of 5-25-03-00345 (Beilstein Handbook Reference) is C41H52N2O5.
What is the molecular weight of 5-25-03-00345 (Beilstein Handbook Reference)?
The molecular weight of 5-25-03-00345 (Beilstein Handbook Reference) is 652.39 g/mol.
Where can I buy 5-25-03-00345 (Beilstein Handbook Reference)?
You can request a quote for 5-25-03-00345 (Beilstein Handbook Reference) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-25-03-00345 (Beilstein Handbook Reference)?
Yes, KEHONG BIO provides custom synthesis services for 5-25-03-00345 (Beilstein Handbook Reference) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.