Chroman 1 (hydrochloride hydrate)

Chroman 1 is an inhibitor of Rho-associated kinase 2 (ROCK2, IC50 = 50s = 1,740 and 127 nM, respectively). Chroman 1 inhibits phosphorylation of myosin light chain (MLC) in a cell-based assay (IC50 = <4 nM).Formal Name: (S)-N-(2-(2-(dimethylamino)ethoxy)-4-(1H-pyrazol-4-yl)phenyl)-6-methoxychromane-3-carboxamide, dihydrochloride hydrate. Synonyms: (S)-Chroman 1. Molecular Formula: C24H28N4O4 . 2HCl [XH2O]. Formula Weight: 527.4. Purity: >98%. Formulation: (Request formulation change), A solid. Solubility: DMSO: 100 mM, Water: 5 mM. SMILES: CN(C)CCOC(C=C(C1=CNN=C1)C=C2)=C2NC([C@H]3CC4=CC(OC)=CC=C4OC3)=O.Cl.Cl.O. InChi Code: InChI=1S/C24H28N4O4.2ClH.H2O/c1-28(2)8-9-31-23-12-16(19-13-25-26-14-19)4-6-21(23)27-24(29)18-10-17-11-20(30-3)5-7-22(17)32-15-18,,,/h4-7,11-14,18H,8-10,15H2,1-3H3,(H,25,26)(H,27,29),2*1H,1H2/t18-,,,/m0.../s1. InChi Key: RBALUPLYQMKKPT-LPECGTQYSA-N.