Ruboxistaurin hydrochloride
(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|LY333531 Hydrochloride|Ruboxistaurin (mesylate)|LY333531Hydrochloride|Ruboxistaurin (hydrochloride)|Ruboxistaurin(hydrochloride)|LY333531 HCl|LY333531 (hydrochloride)|Ruboxistaurin-d6 Hydrochloride|LY-333,531 Hydrochloride|KS-00001CQM|LY-333,531 . hydrochloride|LY-333531 HCl|RUBOXISTAURIN HYDROCHLORIDE [MI]|HB0393|HY-10195B|s7663|LY 333531-d6|CS-5840|RUBOXISTAURIN HYDROCHLORIDE [WHO-DD]|LY 333531|LY333531 Hydrochloride(Ruboxistaurin HCl)|169939-93-9 (HCl)
| Molecular Formula | C28H29ClN4O3 |
|---|---|
| Molecular Weight | 504.1928 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 |
| Monoisotopic 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 504.1928 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.
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