57801-95-3
| Name | 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine, 2-bromo-4-(2-fluorophenyl)-9-methyl- |
| CAS | 57801-95-3 |
| EINECS(EC#) | 200-284-8 |
| Molecular Formula | C15H10BrFN4S |
| Molecular Weight | 377.23 |
| MOL File | 57801-95-3.mol |
Chemical Properties
| solubility | DMF:5.0(Max Conc. mg/mL);13.0(Max Conc. mM) DMSO:5.0(Max Conc. mg/mL);13.0(Max Conc. mM) DMSO:PBS (pH 7.2) (1:1):0.5(Max Conc. mg/mL);1.3(Max Conc. mM) |
| form | A crystalline solid |
| InChI | InChI=1S/C15H10BrFN4S/c1-8-19-20-13-7-18-14(9-4-2-3-5-11(9)17)10-6-12(16)22-15(10)21(8)13/h2-6H,7H2,1H3 |
| InChIKey | VOZDBDBHBXLWCG-UHFFFAOYSA-N |
| SMILES | N12C(C)=NN=C1CN=C(C1=CC=CC=C1F)C1C=C(Br)SC=12 |