Budotitane
TL;DR: Budotitane (CAS 85969-07-9) is a chemical compound with molecular formula C24H28O6Ti and molecular weight 460.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethanolate;bis(1-phenylbutane-1,3-dione);titanium(4+)
Also Known As: Budotitane, Budotitano, Budotitanum, Budotitanum [Latin], Budotitane [INN]
| Molecular Formula | C24H28O6Ti |
|---|---|
| Molecular Weight | 460.14 g/mol |
| LogP | 2.05588 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.13654 |
| Heavy Atoms | 31 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 85969-07-9 |
|---|---|
| SMILES | CC[O-].CC[O-].CC(=O)[CH-]C(=O)C1=CC=CC=C1.CC(=O)[CH-]C(=O)C1=CC=CC=C1.[Ti+4] |
| InChIKey | HYSIJEPDMLSIQJ-UHFFFAOYSA-N |
Product Overview
Budotitane (CAS 85969-07-9), with molecular formula C24H28O6Ti and molecular weight 460.14 g/mol. IUPAC: ethanolate;bis(1-phenylbutane-1,3-dione);titanium(4+).
Chemical Property Profile of Budotitane
Property Insights of Budotitane
The XLogP value of 2.05588 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Budotitane. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Budotitane. Following Lipinski's Rule of Five, Budotitane has 0 hydrogen bond donor(s) and 8 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 Budotitane?
The CAS number of Budotitane is 85969-07-9.
What is the molecular formula of Budotitane?
The molecular formula of Budotitane is C24H28O6Ti.
What is the molecular weight of Budotitane?
The molecular weight of Budotitane is 460.14 g/mol.
Where can I buy Budotitane?
You can request a quote for Budotitane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Budotitane?
Yes, KEHONG BIO provides custom synthesis services for Budotitane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.