Ruboxistaurin hydrochloride
TL;DR: Ruboxistaurin hydrochloride (CAS 192050-59-2) is a chemical compound with molecular formula C28H29ClN4O3 and molecular weight 504.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(18S)-18-[(dimethylamino)methyl]-17-oxa-4,14,21-triazahexacyclo[19.6.1.17,14.02,6.08,13.022,27]nonacosa-1(28),2(6),7(29),8,10,12,22,24,26-nonaene-3,5-dione;hydrochloride
Also Known As: Ruboxistaurin Hydrochloride, Ruboxistaurin, Ruboxistaurin HCl, LY-333531 hydrochloride, LY 333531 hydrochloride
| Molecular Formula | C28H29ClN4O3 |
|---|---|
| Molecular Weight | 504.19 g/mol |
| LogP | 3.9355 |
| Topological Polar Surface Area | 68.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 504.1928 |
| Heavy Atoms | 36 |
| Complexity | 1513.808 |
Chemical Identifiers
| CAS Number | 192050-59-2 |
|---|---|
| SMILES | CN(C)C[C@@H]1CCN2C=C(C3=CC=CC=C32)C4=C(C5=CN(CCO1)C6=CC=CC=C65)C(=O)NC4=O.Cl |
Product Overview
Ruboxistaurin hydrochloride (CAS 192050-59-2), with molecular formula C28H29ClN4O3 and molecular weight 504.19 g/mol. IUPAC: (18S)-18-[(dimethylamino)methyl]-17-oxa-4,14,21-triazahexacyclo[19.6.1.17,14.02,6.08,13.022,27]nonacosa-1(28),2(6),7(29),8,10,12,22,24,26-nonaene-3,5-dione;hydrochloride.
Chemical Property Profile of Ruboxistaurin hydrochloride
Property Insights of Ruboxistaurin hydrochloride
The XLogP value of 3.9355 indicates that Ruboxistaurin hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ruboxistaurin hydrochloride. Following Lipinski's Rule of Five, Ruboxistaurin hydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ruboxistaurin hydrochloride?
The CAS number of Ruboxistaurin hydrochloride is 192050-59-2.
What is the molecular formula of Ruboxistaurin hydrochloride?
The molecular formula of Ruboxistaurin hydrochloride is C28H29ClN4O3.
What is the molecular weight of Ruboxistaurin hydrochloride?
The molecular weight of Ruboxistaurin hydrochloride is 504.19 g/mol.
Where can I buy Ruboxistaurin hydrochloride?
You can request a quote for Ruboxistaurin hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ruboxistaurin hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ruboxistaurin hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.